data_1inz_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 1inz _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.231 0.539 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.458 ' HB2' ' HB2' ' A' ' 52' ' ' ALA . . . -68.37 -52.31 34.57 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.237 -0.914 . . . . 0.0 110.309 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' HD13 ' A' ' 22' ' ' ILE . 0.2 OUTLIER -41.05 -34.03 0.39 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.287 -0.883 . . . . 0.0 110.601 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.469 HD13 ' OE1' ' A' ' 21' ' ' GLU . 20.1 mm -77.88 -41.86 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.095 -1.003 . . . . 0.0 109.964 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.512 ' CE ' ' HG3' ' A' ' 42' ' ' GLU . 13.3 tptt -61.55 -58.65 7.26 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.253 -0.904 . . . . 0.0 109.934 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.528 ' CG2' HG21 ' A' ' 56' ' ' ILE . 53.7 t -45.45 -55.11 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.407 -0.808 . . . . 0.0 110.385 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -52.69 -63.36 1.17 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.913 . . . . 0.0 110.653 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -14.05 5.44 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.401 -0.812 . . . . 0.0 110.714 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.536 ' CB ' HD21 ' A' ' 39' ' ' LEU . . . -86.55 -33.44 20.25 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.134 -0.979 . . . . 0.0 110.328 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.523 ' CA ' ' HB3' ' A' ' 76' ' ' LYS . 19.8 p . . . . . 0 N--CA 1.49 1.551 0 O-C-N 121.288 -0.883 . . . . 0.0 110.119 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.536 HD21 ' CB ' ' A' ' 27' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.314 0.578 . . . . 0.0 110.231 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.439 ' HA ' HD11 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -55.18 -45.02 75.76 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.131 -0.98 . . . . 0.0 110.141 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.451 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 15.6 t -59.72 -29.59 68.22 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.331 -0.855 . . . . 0.0 110.272 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.512 ' HG3' ' CE ' ' A' ' 23' ' ' LYS . 22.0 mm-40 -70.43 -52.06 24.92 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.255 -0.903 . . . . 0.0 110.286 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.528 HG23 ' CD2' ' A' ' 84' ' ' LEU . 7.2 mt -54.24 -35.54 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.183 -0.948 . . . . 0.0 109.992 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.577 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -67.78 -52.21 39.81 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.31 -0.869 . . . . 0.0 109.486 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.448 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 10.8 t0 -53.91 -20.23 5.74 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.087 -1.008 . . . . 0.0 109.187 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 43' ' ' ILE . 8.5 mt -82.7 -38.11 23.83 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.523 -0.736 . . . . 0.0 110.093 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.51 HG22 HG21 ' A' ' 92' ' ' VAL . 72.3 p -51.82 -42.5 62.56 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.243 -0.911 . . . . 0.0 109.377 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.547 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 86.3 m-85 -43.63 -44.56 6.4 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.712 -0.795 . . . . 0.0 109.259 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.463 ' O ' ' O ' ' A' ' 48' ' ' TYR . 2.4 t-20 -56.68 -157.48 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.865 0.84 . . . . 0.0 110.298 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.6 t -125.97 -34.56 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -178.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.57 HG12 ' N ' ' A' ' 52' ' ' ALA . 11.2 t -84.54 -71.91 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 CA-C-O 121.967 0.889 . . . . 0.0 109.84 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.57 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -37.92 -40.79 0.49 Allowed 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.737 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.488 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 8.1 t80 -54.54 -56.4 19.33 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.425 -0.797 . . . . 0.0 110.214 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.45 ' O ' ' HB2' ' A' ' 58' ' ' SER . 3.5 m -58.87 -34.96 72.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.301 -0.874 . . . . 0.0 110.251 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.65 -20.02 60.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.279 -0.888 . . . . 0.0 110.04 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.528 HG21 ' CG2' ' A' ' 24' ' ' VAL . 36.6 mt -80.96 -70.07 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 110.135 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.5 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 70.5 mmm -52.01 -36.06 48.72 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.25 -0.906 . . . . 0.0 109.909 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 54' ' ' SER . 3.5 m -57.02 -62.69 1.57 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.308 -0.87 . . . . 0.0 110.147 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -25.32 61.06 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 109.894 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.541 HD12 ' CD2' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -72.86 -31.34 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.384 -0.823 . . . . 0.0 109.789 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.57 ' CH2' ' SD ' ' A' ' 81' ' ' MET . 14.9 m95 -72.9 -39.84 66.03 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.274 -0.892 . . . . 0.0 110.307 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -58.9 5.81 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.89 . . . . 0.0 110.211 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -63.58 -11.76 27.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.283 -0.885 . . . . 0.0 110.255 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.618 HD21 ' CD1' ' A' ' 106' ' ' LEU . 4.7 mt -80.17 -24.97 40.0 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.299 -0.876 . . . . 0.0 110.337 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 . . . . . 0 C--N 1.303 -1.428 0 O-C-N 121.352 -0.842 . . . . 0.0 109.949 -179.809 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.467 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 69.3 p-90 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.165 0.507 . . . . 0.0 110.178 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -48.21 -45.53 34.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.206 -0.934 . . . . 0.0 109.985 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.408 ' ND1' ' N ' ' A' ' 73' ' ' HIS . 2.8 m-70 -61.64 -36.57 81.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.311 -0.868 . . . . 0.0 109.924 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.58 ' CG1' ' CG2' ' A' ' 123' ' ' VAL . 16.4 t -63.1 -57.24 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.304 -0.873 . . . . 0.0 110.021 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.574 ' CE1' ' HD3' ' A' ' 126' ' ' LYS . 7.0 t80 -49.2 -49.11 44.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 109.928 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.523 ' HB3' ' CA ' ' A' ' 28' ' ' THR . 4.5 tptt -62.07 -31.85 72.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.339 -0.851 . . . . 0.0 109.843 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.539 ' HB2' HD23 ' A' ' 64' ' ' LEU . . . -69.96 -28.02 65.21 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.349 -0.844 . . . . 0.0 109.908 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.56 ' CE ' ' CG2' ' A' ' 123' ' ' VAL . 0.7 OUTLIER -73.34 -30.83 63.6 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.387 -0.82 . . . . 0.0 110.183 179.862 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.4 m -70.79 -36.66 73.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.214 -0.929 . . . . 0.0 109.97 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.541 ' CD2' HD12 ' A' ' 60' ' ' ILE . 42.0 tp -77.11 -31.4 55.8 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.318 -0.864 . . . . 0.0 109.677 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.57 ' SD ' ' CH2' ' A' ' 61' ' ' TRP . 31.0 ttp -76.71 -28.12 55.74 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.395 -0.815 . . . . 0.0 109.882 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.524 ' HB2' ' CD1' ' A' ' 130' ' ' LEU . 26.9 tt0 -85.33 -34.97 21.72 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.262 -0.899 . . . . 0.0 110.026 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.451 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 31.8 t80 -70.58 -45.34 65.57 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.309 -0.87 . . . . 0.0 110.257 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.577 HD23 ' HB2' ' A' ' 44' ' ' ALA . 50.7 mt -67.46 -40.41 85.36 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.274 -0.892 . . . . 0.0 110.16 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.529 ' N ' HG13 ' A' ' 92' ' ' VAL . 26.5 mt -56.75 -20.72 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 109.973 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 -82.4 0.41 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.24 -0.913 . . . . 0.0 110.013 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.449 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 7.6 t -76.6 -25.9 54.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.293 -0.879 . . . . 0.0 110.149 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.547 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -44.24 -69.58 0.69 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.424 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 176.61 176.16 0.31 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.224 -1.162 . . . . 0.0 110.215 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -79.12 -15.18 58.51 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 110.257 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 47' ' ' THR . 2.2 ptm180 -82.84 -28.59 30.02 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.132 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.529 HG13 ' N ' ' A' ' 85' ' ' ILE . 95.0 t -69.25 -31.18 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.198 -0.938 . . . . 0.0 109.628 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.453 ' OG ' HG22 ' A' ' 85' ' ' ILE . 74.5 m -78.81 -35.85 43.58 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.308 -0.87 . . . . 0.0 109.623 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.58 -41.11 98.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.381 -0.824 . . . . 0.0 109.714 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.21 -35.71 81.9 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.442 -0.786 . . . . 0.0 109.489 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.498 ' SG ' ' CD1' ' A' ' 134' ' ' LEU . 35.2 t -60.14 -39.8 87.6 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.436 -0.79 . . . . 0.0 109.676 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -33.09 69.24 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.437 -0.789 . . . . 0.0 109.776 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -78.15 -17.73 56.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.389 -0.819 . . . . 0.0 109.903 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -124.45 37.97 4.29 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.46 -0.775 . . . . 0.0 109.928 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -60.19 -29.06 68.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.307 -0.871 . . . . 0.0 110.192 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -64.89 -28.06 69.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.274 -0.892 . . . . 0.0 109.899 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.525 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -75.68 -42.79 50.21 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.378 -0.826 . . . . 0.0 110.042 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.5 HG13 ' CG2' ' A' ' 131' ' ' VAL . 3.3 t -71.75 -26.56 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.344 -0.847 . . . . 0.0 110.175 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.465 ' HG2' HG23 ' A' ' 131' ' ' VAL . 0.8 OUTLIER -85.31 -27.72 25.75 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.329 -0.857 . . . . 0.0 110.311 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.525 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 6.4 t -56.58 -17.0 7.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.313 -0.867 . . . . 0.0 110.037 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.618 ' CD1' HD21 ' A' ' 64' ' ' LEU . 17.4 mt -80.12 -40.73 26.87 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.286 -0.884 . . . . 0.0 110.097 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 124' ' ' ARG . 13.6 ttpt . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.217 -0.927 . . . . 0.0 110.077 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.56 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.3 p . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 121.335 0.588 . . . . 0.0 110.169 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.56 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.9 OUTLIER -44.41 -37.17 3.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.367 -0.833 . . . . 0.0 109.9 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.58 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 8.5 p -79.75 -38.01 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.46 ' N ' ' CG1' ' A' ' 123' ' ' VAL . 5.1 ttp180 -54.9 -55.41 30.82 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.242 -0.911 . . . . 0.0 110.394 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -67.94 -28.68 67.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.411 -0.806 . . . . 0.0 110.529 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.574 ' HD3' ' CE1' ' A' ' 75' ' ' TYR . 2.3 tptt -60.51 -58.77 7.09 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.179 -0.951 . . . . 0.0 109.899 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.507 ' CB ' ' HB2' ' A' ' 106' ' ' LEU . . . -54.99 -42.67 72.77 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.395 -0.816 . . . . 0.0 110.099 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.67 -35.34 74.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.244 -0.91 . . . . 0.0 110.165 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -65.13 -52.64 54.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.3 -0.875 . . . . 0.0 110.464 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.524 ' CD1' ' HB2' ' A' ' 82' ' ' GLU . 0.1 OUTLIER -48.54 -39.56 23.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.218 -0.926 . . . . 0.0 110.443 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.5 ' CG2' HG13 ' A' ' 103' ' ' VAL . 11.8 t -77.32 -30.8 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.231 -0.918 . . . . 0.0 110.323 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.25 -56.67 12.98 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.204 -0.935 . . . . 0.0 110.172 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.4 mp -58.96 -53.12 61.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.263 -0.898 . . . . 0.0 110.31 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.516 ' CD1' ' O ' ' A' ' 130' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.197 -0.939 . . . . 0.0 110.156 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.124 0.487 . . . . 0.0 110.305 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.497 ' HA ' ' CD1' ' A' ' 46' ' ' LEU . . . -79.13 -48.74 13.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -0.884 . . . . 0.0 110.12 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.481 ' CG ' HG13 ' A' ' 22' ' ' ILE . 9.5 pt-20 -47.51 -32.31 5.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.342 -0.849 . . . . 0.0 110.241 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.481 HG13 ' CG ' ' A' ' 21' ' ' GLU . 28.8 mt -80.25 -43.6 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.258 -0.901 . . . . 0.0 110.172 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.472 ' O ' HD13 ' A' ' 43' ' ' ILE . 5.5 mmtm -57.64 -30.46 65.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.256 -0.902 . . . . 0.0 110.193 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.499 ' CG2' HG21 ' A' ' 56' ' ' ILE . 44.2 t -77.94 -46.92 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.242 -0.911 . . . . 0.0 110.119 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.85 -39.7 26.68 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.336 -0.852 . . . . 0.0 110.102 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -76.29 -37.96 56.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.398 -0.814 . . . . 0.0 110.121 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.518 ' CB ' HD23 ' A' ' 39' ' ' LEU . . . -65.49 -13.26 58.44 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.322 -0.861 . . . . 0.0 109.964 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.528 ' HA ' ' CB ' ' A' ' 76' ' ' LYS . 8.5 p . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.284 -0.885 . . . . 0.0 110.188 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.518 HD23 ' CB ' ' A' ' 27' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.189 0.519 . . . . 0.0 110.212 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.1 ttt -71.95 -60.54 2.18 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.29 -0.882 . . . . 0.0 110.18 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.459 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 82.7 p -53.84 -25.27 18.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.254 -0.904 . . . . 0.0 110.064 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -75.54 -53.17 9.05 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 110.114 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.525 ' CG2' HD13 ' A' ' 80' ' ' LEU . 59.3 mt -54.71 -35.3 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.297 -0.877 . . . . 0.0 110.134 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.544 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -71.75 -49.98 34.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.221 -0.924 . . . . 0.0 109.548 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -53.29 -21.13 5.03 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.059 -1.025 . . . . 0.0 108.827 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.526 ' O ' ' CB ' ' A' ' 52' ' ' ALA . 14.8 mt -79.25 -38.21 36.12 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.621 -0.674 . . . . 0.0 109.852 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.49 ' OG1' ' O ' ' A' ' 44' ' ' ALA . 72.7 p -51.91 -43.76 63.53 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.103 -0.998 . . . . 0.0 109.156 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.43 ' CE2' ' O ' ' A' ' 87' ' ' THR . 87.5 m-85 -44.67 -42.99 7.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.285 -0.884 . . . . 0.0 109.578 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.543 ' O ' ' C ' ' A' ' 50' ' ' VAL . 14.7 m-20 -72.96 90.65 1.49 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.469 -0.77 . . . . 0.0 110.348 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.543 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.2 -59.04 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.25 178.295 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.537 HG13 ' N ' ' A' ' 52' ' ' ALA . 2.6 t -62.98 -64.17 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.09 -1.006 . . . . 0.0 110.1 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.537 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -37.81 -47.48 1.02 Allowed 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 121.171 0.51 . . . . 0.0 110.846 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.552 ' CZ ' ' OE1' ' A' ' 95' ' ' GLN . 9.7 t80 -56.36 -54.28 47.4 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.292 -0.88 . . . . 0.0 110.289 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.06 -27.59 54.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.219 -0.926 . . . . 0.0 110.196 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -82.92 -25.31 32.54 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.301 -0.874 . . . . 0.0 110.208 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.519 HG23 HD13 ' A' ' 84' ' ' LEU . 8.7 mt -79.21 -69.96 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.361 -0.837 . . . . 0.0 109.945 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.535 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 52.0 mmm -45.85 -37.69 6.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.155 -0.966 . . . . 0.0 109.745 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.3 t -55.19 -61.44 2.33 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.347 -0.845 . . . . 0.0 109.893 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.413 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -59.21 -21.45 59.52 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.153 -0.967 . . . . 0.0 109.859 179.689 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.547 HG23 HD11 ' A' ' 64' ' ' LEU . 0.4 OUTLIER -76.24 -30.77 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.375 -0.828 . . . . 0.0 109.768 179.781 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 57' ' ' MET . 30.2 m95 -77.51 -51.0 11.45 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.891 . . . . 0.0 110.022 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.98 -51.77 49.41 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.241 -0.912 . . . . 0.0 109.969 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -69.01 -24.25 64.19 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.265 -0.897 . . . . 0.0 110.094 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.586 HD22 ' CD1' ' A' ' 106' ' ' LEU . 4.5 mt -71.07 -25.54 62.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.425 -0.797 . . . . 0.0 110.314 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.447 ' OD1' ' O ' ' A' ' 65' ' ' ASN . 18.1 t-20 . . . . . 0 N--CA 1.487 1.403 0 O-C-N 121.307 -0.871 . . . . 0.0 109.89 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.446 ' CE3' ' HB2' ' A' ' 75' ' ' TYR . 51.7 p-90 . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.16 0.505 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' A' ' 71' ' ' TRP . 42.7 mtt-85 -43.18 -41.92 3.96 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.315 -0.866 . . . . 0.0 110.404 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.438 ' O ' ' HB2' ' A' ' 77' ' ' ALA . 31.1 m-70 -68.0 -43.84 77.97 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.107 -0.996 . . . . 0.0 110.248 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.549 HG12 ' HE2' ' A' ' 78' ' ' MET . 70.5 t -56.08 -51.49 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.253 -0.904 . . . . 0.0 110.297 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.446 ' HB2' ' CE3' ' A' ' 71' ' ' TRP . 6.1 t80 -49.78 -64.56 0.77 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.141 -0.974 . . . . 0.0 109.975 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.528 ' CB ' ' HA ' ' A' ' 28' ' ' THR . 1.1 mmpt? -55.21 -21.7 14.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.327 -0.858 . . . . 0.0 110.044 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.559 ' HB1' HD21 ' A' ' 64' ' ' LEU . . . -69.79 -37.97 76.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.182 -0.949 . . . . 0.0 110.186 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.549 ' HE2' HG12 ' A' ' 74' ' ' VAL . 2.8 mpp? -68.39 -41.67 80.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.361 -0.837 . . . . 0.0 110.195 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.6 m -58.41 -45.99 87.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -0.889 . . . . 0.0 110.399 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.528 HD21 ' CG1' ' A' ' 60' ' ' ILE . 18.2 tp -58.45 -60.27 4.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.268 -0.895 . . . . 0.0 109.926 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.476 ' HE2' ' CZ3' ' A' ' 61' ' ' TRP . 28.1 ttm -53.78 -21.97 8.45 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.204 -0.935 . . . . 0.0 110.101 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.523 ' CA ' HD11 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -79.89 -37.89 33.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.236 -0.915 . . . . 0.0 110.716 -179.751 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.617 ' CE1' ' CG2' ' A' ' 87' ' ' THR . 32.3 t80 -81.0 -22.66 39.25 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.238 -0.914 . . . . 0.0 110.784 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.544 HD23 ' HB2' ' A' ' 44' ' ' ALA . 48.2 mt -85.17 -21.44 29.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.206 -0.934 . . . . 0.0 110.075 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.56 ' N ' HG12 ' A' ' 92' ' ' VAL . 33.2 mt -76.64 -13.98 14.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.316 -0.865 . . . . 0.0 109.553 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -105.39 -48.02 3.8 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.382 -0.824 . . . . 0.0 110.044 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.617 ' CG2' ' CE1' ' A' ' 83' ' ' TYR . 7.6 t -114.48 -2.72 13.12 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.272 -0.892 . . . . 0.0 110.168 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.548 ' O ' ' CB ' ' A' ' 89' ' ' SER . . . -89.88 34.88 3.92 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.548 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 2.5 t 74.28 150.14 0.11 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.447 -1.031 . . . . 0.0 110.157 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -65.18 -7.93 14.92 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.354 -0.841 . . . . 0.0 110.598 -179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -72.1 -38.47 69.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.111 -0.993 . . . . 0.0 109.732 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.56 HG12 ' N ' ' A' ' 85' ' ' ILE . 84.0 t -60.08 -28.92 42.52 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.372 -0.83 . . . . 0.0 109.937 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.486 ' CB ' HG22 ' A' ' 85' ' ' ILE . 10.3 p -83.57 -38.92 21.03 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.283 -0.886 . . . . 0.0 109.982 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -58.03 -57.89 10.83 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.228 -0.92 . . . . 0.0 109.694 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.552 ' OE1' ' CZ ' ' A' ' 53' ' ' PHE . 34.8 tt0 -52.79 -35.7 57.09 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.454 -0.778 . . . . 0.0 109.448 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.7 t -55.41 -44.23 76.01 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 109.563 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -66.0 -46.81 76.65 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.497 -0.752 . . . . 0.0 109.747 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -65.01 -16.12 63.08 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.408 -0.807 . . . . 0.0 109.797 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.5 32.81 4.95 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.366 -0.834 . . . . 0.0 109.844 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.1 mtp -61.63 -28.26 69.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.298 -0.876 . . . . 0.0 110.224 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.467 ' O ' ' HB ' ' A' ' 105' ' ' THR . 15.6 m-85 -66.84 -24.97 66.21 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.236 -0.915 . . . . 0.0 109.934 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.528 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -76.59 -40.88 48.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.885 . . . . 0.0 110.008 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.46 HG12 HG21 ' A' ' 131' ' ' VAL . 2.9 t -75.06 -27.04 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.351 -0.843 . . . . 0.0 109.903 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.451 ' NE2' HG11 ' A' ' 131' ' ' VAL . 95.7 mt-30 -85.7 -28.24 24.79 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.411 -0.806 . . . . 0.0 109.985 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.528 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 7.4 t -53.44 -24.79 13.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.903 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.586 ' CD1' HD22 ' A' ' 64' ' ' LEU . 42.0 mt -70.53 -38.48 74.25 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.392 -0.818 . . . . 0.0 109.955 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.528 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 14.4 ttpt . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.245 -0.909 . . . . 0.0 109.888 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.555 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.1 p . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 121.335 0.588 . . . . 0.0 110.353 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.555 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.2 m-80 -40.91 -46.94 2.89 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.482 -0.761 . . . . 0.0 110.271 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.536 ' CG1' HG13 ' A' ' 74' ' ' VAL . 0.9 OUTLIER -66.33 -42.92 91.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.319 -0.863 . . . . 0.0 109.867 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.528 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -56.87 -67.85 0.27 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.188 -0.945 . . . . 0.0 111.063 -179.554 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.18 -35.95 76.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.284 -0.885 . . . . 0.0 111.331 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 0.0 OUTLIER -57.56 -54.14 50.2 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.111 -0.993 . . . . 0.0 110.446 -179.561 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.464 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -57.25 -40.8 78.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.38 -0.825 . . . . 0.0 110.068 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt -62.5 -33.72 75.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.183 -0.948 . . . . 0.0 110.241 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.71 -40.27 96.63 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.287 -0.883 . . . . 0.0 110.586 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.523 HD11 ' CA ' ' A' ' 82' ' ' GLU . 0.6 OUTLIER -62.5 -53.05 60.44 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.248 -0.907 . . . . 0.0 110.569 -179.677 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.46 HG21 HG12 ' A' ' 103' ' ' VAL . 25.3 t -65.84 -25.68 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.408 -0.807 . . . . 0.0 110.413 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.92 -55.55 16.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.25 -0.906 . . . . 0.0 110.509 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.85 -56.94 15.17 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.137 -0.977 . . . . 0.0 110.307 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.527 ' CD1' HG21 ' A' ' 85' ' ' ILE . 3.0 mp . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.23 -0.919 . . . . 0.0 110.136 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.505 ' HB2' ' CD1' ' A' ' 22' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.205 0.526 . . . . 0.0 110.23 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.524 ' CB ' HD22 ' A' ' 46' ' ' LEU . . . -64.89 -56.8 11.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 110.216 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' A' ' 20' ' ' ALA . 18.8 pt-20 -42.96 -28.52 0.26 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.255 -0.903 . . . . 0.0 110.039 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.505 ' CD1' ' HB2' ' A' ' 19' ' ' GLU . 40.8 mt -74.19 -57.65 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.314 -0.866 . . . . 0.0 110.037 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.469 ' CB ' HG12 ' A' ' 43' ' ' ILE . 1.8 mmpt? -48.09 -51.05 26.14 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.351 -0.843 . . . . 0.0 110.214 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.531 HG21 HG22 ' A' ' 56' ' ' ILE . 20.0 t -56.28 -36.28 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.286 -0.884 . . . . 0.0 110.207 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.4 ttt85 -67.05 -38.14 85.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.2 -0.937 . . . . 0.0 110.177 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.431 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -81.18 -14.75 57.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.265 -0.897 . . . . 0.0 109.966 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.578 ' CB ' ' CD2' ' A' ' 39' ' ' LEU . . . -77.72 -20.29 53.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.867 . . . . 0.0 110.244 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.482 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 30.2 p . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.226 -0.921 . . . . 0.0 110.251 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.578 ' CD2' ' CB ' ' A' ' 27' ' ' ALA . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.255 0.55 . . . . 0.0 110.263 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.512 ' CE ' HG22 ' A' ' 79' ' ' THR . 6.9 mmm -84.79 -45.79 12.01 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.186 -0.946 . . . . 0.0 110.207 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.466 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.2 OUTLIER -63.97 -29.34 70.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.355 -0.84 . . . . 0.0 110.277 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -72.77 -49.64 29.55 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.938 . . . . 0.0 110.102 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.517 HD11 HG23 ' A' ' 43' ' ' ILE . 44.7 mt -55.91 -33.87 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.273 -0.892 . . . . 0.0 110.022 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.564 ' HB1' HD22 ' A' ' 84' ' ' LEU . . . -71.63 -52.9 15.56 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.236 -0.915 . . . . 0.0 109.401 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.449 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 7.4 t70 -51.82 -22.38 3.63 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.059 -1.025 . . . . 0.0 108.742 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.524 HD22 ' CB ' ' A' ' 20' ' ' ALA . 8.1 mt -78.24 -40.03 38.47 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.611 -0.681 . . . . 0.0 110.017 179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.542 HG22 HG21 ' A' ' 92' ' ' VAL . 73.1 p -49.69 -42.0 44.64 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.11 -0.994 . . . . 0.0 109.159 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.561 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 83.7 m-85 -45.52 -46.27 13.85 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.234 -0.916 . . . . 0.0 109.367 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 50' ' ' VAL . 22.7 m-20 -71.14 89.65 0.85 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.529 -0.732 . . . . 0.0 110.358 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.73 -57.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.561 178.228 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.555 HG11 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -63.07 -65.9 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.04 -1.037 . . . . 0.0 110.069 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.555 ' N ' HG11 ' A' ' 51' ' ' VAL . . . -38.16 -42.43 0.67 Allowed 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.305 0.574 . . . . 0.0 110.602 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.538 ' CE1' HG23 ' A' ' 92' ' ' VAL . 10.0 t80 -59.56 -53.65 55.67 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.376 -0.828 . . . . 0.0 109.952 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -30.36 62.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.28 -0.887 . . . . 0.0 109.745 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.68 -25.67 41.18 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.307 -0.871 . . . . 0.0 110.178 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.531 HG22 HG21 ' A' ' 24' ' ' VAL . 6.9 mt -77.59 -70.18 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.324 -0.86 . . . . 0.0 110.283 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.472 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 91.6 mmm -47.75 -36.31 11.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.21 -0.931 . . . . 0.0 109.91 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 t -55.21 -60.67 3.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.377 -0.827 . . . . 0.0 109.971 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.27 -25.6 65.83 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -0.953 . . . . 0.0 109.687 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.536 HD12 ' CD2' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -71.1 -29.59 37.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.379 -0.825 . . . . 0.0 109.506 179.641 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.558 ' CE3' HD12 ' A' ' 64' ' ' LEU . 13.4 m95 -78.21 -41.04 35.69 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.239 -0.913 . . . . 0.0 109.964 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.78 -53.03 53.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.329 -0.857 . . . . 0.0 109.964 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.467 ' HB3' ' HB3' ' A' ' 73' ' ' HIS . 4.0 mmt180 -70.06 -33.83 72.43 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.381 -0.824 . . . . 0.0 109.992 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.607 HD22 ' CD1' ' A' ' 106' ' ' LEU . 11.8 mt -65.11 -9.45 22.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.447 -0.783 . . . . 0.0 110.357 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--N 1.302 -1.473 0 O-C-N 121.307 -0.87 . . . . 0.0 110.156 -179.857 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.447 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 35.7 p-90 . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.209 0.528 . . . . 0.0 110.048 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -52.56 -39.59 61.66 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.392 -0.817 . . . . 0.0 110.287 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.467 ' HB3' ' HB3' ' A' ' 63' ' ' ARG . 5.0 m-70 -61.99 -36.81 82.6 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.207 -0.933 . . . . 0.0 110.111 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.543 HG12 ' HE1' ' A' ' 78' ' ' MET . 24.5 t -59.06 -54.54 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.31 -0.869 . . . . 0.0 110.125 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.447 ' HA ' ' HE3' ' A' ' 78' ' ' MET . 22.7 t80 -49.91 -56.45 10.5 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.183 -0.948 . . . . 0.0 109.995 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.482 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -59.74 -25.81 65.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.352 -0.843 . . . . 0.0 110.036 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.532 ' HB1' ' CD2' ' A' ' 64' ' ' LEU . . . -73.12 -27.43 61.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.317 -0.864 . . . . 0.0 110.038 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.543 ' HE1' HG12 ' A' ' 74' ' ' VAL . 1.5 mpp? -74.76 -32.96 62.21 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.327 -0.858 . . . . 0.0 109.991 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.512 HG22 ' CE ' ' A' ' 40' ' ' MET . 35.9 m -74.69 -27.74 60.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.399 -0.813 . . . . 0.0 110.283 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.536 ' CD2' HD12 ' A' ' 60' ' ' ILE . 19.5 tp -76.09 -53.49 8.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.161 -0.962 . . . . 0.0 109.378 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.512 ' O ' ' CD1' ' A' ' 85' ' ' ILE . 6.5 ttp -61.39 -20.62 63.24 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.158 -0.964 . . . . 0.0 109.724 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.502 ' CB ' HD13 ' A' ' 130' ' ' LEU . 13.4 tm-20 -88.36 -33.49 17.93 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.167 -0.958 . . . . 0.0 110.354 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.488 ' CD1' ' O ' ' A' ' 83' ' ' TYR . 10.5 t80 -79.87 -21.92 43.48 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.269 -0.894 . . . . 0.0 110.467 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.564 HD22 ' HB1' ' A' ' 44' ' ' ALA . 68.5 mt -88.86 -34.74 16.89 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.261 -0.899 . . . . 0.0 110.021 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.524 HG21 ' CD2' ' A' ' 134' ' ' LEU . 37.5 mt -56.95 -22.95 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.061 -1.024 . . . . 0.0 109.972 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -95.24 -80.49 0.41 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.233 -0.917 . . . . 0.0 110.284 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.471 HG21 ' CB ' ' A' ' 44' ' ' ALA . 7.9 t -75.65 -24.44 56.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.254 -0.904 . . . . 0.0 110.319 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.561 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -49.34 -77.29 0.13 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.0 t 177.09 154.16 0.24 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.251 -1.146 . . . . 0.0 110.31 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 1.6 mt-10 -55.92 -17.19 5.91 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.902 . . . . 0.0 110.303 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -77.02 -38.02 53.81 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.181 -0.949 . . . . 0.0 110.11 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.542 HG21 HG22 ' A' ' 47' ' ' THR . 73.1 t -59.67 -38.96 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.213 -0.929 . . . . 0.0 110.084 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.91 -40.24 72.28 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.881 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 90' ' ' GLU . 5.6 mt-30 -60.72 -39.77 89.81 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.229 -0.919 . . . . 0.0 109.994 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.408 ' HA ' ' OE1' ' A' ' 95' ' ' GLN . 3.5 tp60 -65.07 -39.59 93.46 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.321 -0.862 . . . . 0.0 109.259 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.513 ' CB ' HD11 ' A' ' 134' ' ' LEU . 2.8 m -56.2 -41.31 75.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.341 -0.849 . . . . 0.0 109.503 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 22.0 mtmt -67.56 -32.46 73.25 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.497 -0.752 . . . . 0.0 109.441 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -80.31 -14.32 58.47 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.411 -0.805 . . . . 0.0 109.68 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -129.86 33.4 4.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.452 -0.78 . . . . 0.0 110.08 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.526 ' HE1' ' CE2' ' A' ' 101' ' ' TYR . 8.4 ptt? -60.74 -28.94 69.07 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.247 -0.908 . . . . 0.0 110.252 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.526 ' CE2' ' HE1' ' A' ' 100' ' ' MET . 41.5 m-85 -65.61 -26.4 67.81 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.337 -0.852 . . . . 0.0 110.198 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.506 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -76.65 -41.4 45.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 110.133 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.526 HG13 ' CG2' ' A' ' 131' ' ' VAL . 2.5 t -73.2 -25.85 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.324 -0.86 . . . . 0.0 109.989 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.421 ' CG ' HG12 ' A' ' 131' ' ' VAL . 16.7 mt-30 -87.65 -24.82 23.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.287 -0.883 . . . . 0.0 110.452 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.506 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 12.0 t -63.59 -12.61 34.57 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.186 -0.946 . . . . 0.0 110.368 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.607 ' CD1' HD22 ' A' ' 64' ' ' LEU . 17.4 mt -73.86 -40.05 63.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.189 -0.944 . . . . 0.0 110.219 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.161 -0.962 . . . . 0.0 110.025 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.561 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.9 p . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 121.332 0.587 . . . . 0.0 110.26 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.561 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 2.6 t30 -40.56 -27.68 0.05 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.595 -0.69 . . . . 0.0 110.257 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.523 ' CG1' HG13 ' A' ' 74' ' ' VAL . 2.0 t -76.74 -49.23 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.245 -0.909 . . . . 0.0 109.968 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -60.34 -36.8 78.81 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.116 -0.99 . . . . 0.0 110.802 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -77.93 -61.41 2.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.183 -0.948 . . . . 0.0 110.88 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -48.65 -44.52 37.62 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.151 -0.968 . . . . 0.0 110.268 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.482 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -65.38 -44.14 88.49 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.298 -0.876 . . . . 0.0 110.411 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -49.79 -39.13 37.12 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.186 -0.946 . . . . 0.0 110.505 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -71.31 -50.95 27.31 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.221 -0.924 . . . . 0.0 110.438 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.502 HD13 ' CB ' ' A' ' 82' ' ' GLU . 11.9 tp -49.48 -22.31 1.17 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.247 -0.908 . . . . 0.0 110.317 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.526 ' CG2' HG13 ' A' ' 103' ' ' VAL . 42.8 t -92.19 -31.76 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 110.304 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . 0.408 ' O ' ' C ' ' A' ' 133' ' ' LEU . . . -70.37 -63.13 1.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.318 -0.864 . . . . 0.0 110.302 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.408 ' C ' ' O ' ' A' ' 132' ' ' ALA . 13.2 tp -43.53 -27.42 0.29 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.228 -0.92 . . . . 0.0 110.351 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.524 ' CD2' HG21 ' A' ' 85' ' ' ILE . 20.5 mt . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.914 . . . . 0.0 110.335 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.446 ' O ' ' HB ' ' A' ' 22' ' ' ILE . 4.5 mt-10 . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.093 0.473 . . . . 0.0 110.344 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.521 ' HB3' ' CD1' ' A' ' 46' ' ' LEU . . . -57.19 -50.45 72.8 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.918 . . . . 0.0 110.095 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.46 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 1.2 pt-20 -48.52 -28.06 3.12 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.203 -0.936 . . . . 0.0 109.897 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.446 ' HB ' ' O ' ' A' ' 19' ' ' GLU . 49.3 mm -73.29 -41.47 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.295 -0.878 . . . . 0.0 109.904 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.456 ' CB ' HG12 ' A' ' 43' ' ' ILE . 11.6 mmtt -64.56 -42.75 95.47 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.253 -0.904 . . . . 0.0 109.907 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.522 HG13 ' CD2' ' A' ' 80' ' ' LEU . 14.8 t -64.81 -30.65 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.264 -0.897 . . . . 0.0 110.03 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -62.34 -42.69 99.59 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.201 -0.937 . . . . 0.0 110.04 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -83.44 -19.88 35.12 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.48 -0.763 . . . . 0.0 110.108 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.464 ' CB ' ' CD2' ' A' ' 39' ' ' LEU . . . -81.25 -14.16 57.74 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.307 -0.87 . . . . 0.0 110.25 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.473 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 3.8 p . . . . . 0 N--CA 1.491 1.623 0 O-C-N 121.24 -0.912 . . . . 0.0 110.292 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.464 ' CD2' ' CB ' ' A' ' 27' ' ' ALA . 1.9 tp . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.177 0.513 . . . . 0.0 110.369 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -44.45 77.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.266 -0.896 . . . . 0.0 110.497 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.46 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.1 OUTLIER -66.5 -28.25 68.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.171 -0.956 . . . . 0.0 110.589 -179.767 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.68 -47.73 44.97 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.203 -0.936 . . . . 0.0 110.257 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.492 HG21 ' CG2' ' A' ' 24' ' ' VAL . 62.6 mt -57.25 -36.09 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.177 -0.952 . . . . 0.0 110.029 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.496 ' O ' ' OG1' ' A' ' 47' ' ' THR . . . -70.33 -49.84 45.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.174 -0.954 . . . . 0.0 109.522 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -51.25 -22.27 2.61 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.029 -1.044 . . . . 0.0 108.831 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.521 ' CD1' ' HB3' ' A' ' 20' ' ' ALA . 12.4 mt -81.99 -37.99 25.79 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.623 -0.673 . . . . 0.0 110.245 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.498 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 71.8 p -50.51 -40.53 51.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.111 -0.993 . . . . 0.0 109.474 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 49' ' ' ASN . 66.9 m-85 -44.61 -46.75 10.23 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 119.624 -0.83 . . . . 0.0 109.122 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.473 ' O ' ' O ' ' A' ' 48' ' ' TYR . 0.8 OUTLIER -55.62 -158.76 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 CA-C-O 121.98 0.895 . . . . 0.0 110.498 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.428 ' CG2' ' N ' ' A' ' 51' ' ' VAL . 3.1 m -125.5 -34.67 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -178.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.554 HG11 ' N ' ' A' ' 52' ' ' ALA . 8.5 t -82.88 -70.64 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 CA-C-O 122.07 0.938 . . . . 0.0 109.618 178.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.554 ' N ' HG11 ' A' ' 51' ' ' VAL . . . -40.37 -41.58 1.4 Allowed 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.247 -178.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.575 ' CE1' HG22 ' A' ' 92' ' ' VAL . 12.6 t80 -56.2 -52.6 63.84 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.471 -0.768 . . . . 0.0 109.861 179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.452 ' O ' ' HB2' ' A' ' 58' ' ' SER . 40.9 t -60.49 -26.86 67.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.316 -0.865 . . . . 0.0 109.643 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.46 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 1.7 mm-40 -81.45 -21.56 38.74 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.47 -0.769 . . . . 0.0 109.782 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.519 HG21 HG23 ' A' ' 24' ' ' VAL . 7.7 mt -81.78 -70.12 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.328 -0.857 . . . . 0.0 109.851 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.458 ' HA ' HD13 ' A' ' 60' ' ' ILE . 79.8 mmm -49.73 -36.68 26.42 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.31 -0.869 . . . . 0.0 109.73 179.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 54' ' ' SER . 2.2 m -55.83 -60.41 3.5 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.316 -0.865 . . . . 0.0 109.696 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.38 -23.84 62.93 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.253 -0.904 . . . . 0.0 109.674 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.557 HG21 HD13 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -71.64 -33.14 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.427 -0.796 . . . . 0.0 109.569 179.776 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.452 ' CH2' ' HE3' ' A' ' 81' ' ' MET . 28.2 m95 -77.91 -31.35 51.12 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.212 -0.93 . . . . 0.0 109.998 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.93 -57.51 7.69 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.271 -0.893 . . . . 0.0 110.108 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.421 ' O ' HG22 ' A' ' 74' ' ' VAL . 13.7 mmt180 -66.42 -9.89 38.43 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.191 -0.943 . . . . 0.0 109.906 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.558 HD22 ' HB1' ' A' ' 77' ' ' ALA . 6.2 mt -84.83 -17.65 37.4 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.343 -0.848 . . . . 0.0 110.325 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.0 m-20 . . . . . 0 C--N 1.302 -1.458 0 O-C-N 121.238 -0.914 . . . . 0.0 109.904 -179.738 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.406 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 70.0 p-90 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.261 0.553 . . . . 0.0 110.142 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 13.2 mtp180 -52.63 -41.89 64.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.22 -0.925 . . . . 0.0 110.234 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.403 ' CE1' ' NH1' ' A' ' 63' ' ' ARG . 10.0 m170 -60.62 -41.59 95.17 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.192 -0.943 . . . . 0.0 110.085 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.55 HG12 ' HE2' ' A' ' 78' ' ' MET . 24.7 t -56.05 -50.8 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.289 -0.882 . . . . 0.0 110.022 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.558 ' CE1' ' O ' ' A' ' 122' ' ' ASN . 7.4 t80 -49.47 -56.7 8.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.207 -0.933 . . . . 0.0 110.226 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -59.19 -26.93 65.24 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.196 -0.94 . . . . 0.0 109.951 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.558 ' HB1' HD22 ' A' ' 64' ' ' LEU . . . -70.15 -28.68 65.54 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 110.182 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.55 ' HE2' HG12 ' A' ' 74' ' ' VAL . 1.6 mpp? -76.43 -32.08 58.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.405 -0.809 . . . . 0.0 110.229 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 9.9 m -66.9 -40.18 87.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.082 -1.011 . . . . 0.0 110.122 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.542 ' HG ' ' CD1' ' A' ' 84' ' ' LEU . 16.2 tp -64.94 -54.14 35.42 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.333 -0.854 . . . . 0.0 109.783 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.509 ' CG ' HD13 ' A' ' 85' ' ' ILE . 0.2 OUTLIER -59.19 -25.27 63.81 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.868 . . . . 0.0 109.887 179.561 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.531 ' CA ' HD11 ' A' ' 130' ' ' LEU . 0.9 OUTLIER -78.46 -34.13 47.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.252 -0.905 . . . . 0.0 110.385 179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.46 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 26.0 t80 -85.6 -16.61 38.72 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.262 -0.899 . . . . 0.0 110.714 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.542 ' CD1' ' HG ' ' A' ' 80' ' ' LEU . 85.1 mt -92.54 -38.98 11.62 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.166 -0.959 . . . . 0.0 110.232 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.536 ' CD1' HD23 ' A' ' 130' ' ' LEU . 52.0 mt -57.1 -17.19 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.115 -0.991 . . . . 0.0 109.807 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.58 -80.54 0.47 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.294 -0.879 . . . . 0.0 110.191 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.458 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 15.0 t -77.72 -18.77 56.22 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.201 -0.937 . . . . 0.0 110.142 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.464 ' HA3' ' O ' ' A' ' 84' ' ' LEU . . . -55.99 -74.35 0.33 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.212 -1.555 . . . . 0.0 109.212 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.409 ' OG ' ' HA ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER 174.47 152.43 0.11 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -1.12 . . . . 0.0 110.337 179.767 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -51.98 -24.43 6.53 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 110.109 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.51 ' O ' ' HG2' ' A' ' 94' ' ' GLN . 40.4 mtt180 -70.26 -44.23 68.88 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.304 -0.873 . . . . 0.0 109.722 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.575 HG22 ' CE1' ' A' ' 53' ' ' PHE . 39.7 t -59.04 -22.16 21.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 120.874 -1.141 . . . . 0.0 108.995 179.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.475 ' HB2' HG23 ' A' ' 85' ' ' ILE . 1.9 t -95.18 -19.2 20.26 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.585 -0.697 . . . . 0.0 110.49 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.598 ' CG ' ' N ' ' A' ' 95' ' ' GLN . 7.2 pt20 -79.53 -48.2 14.26 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.93 -1.106 . . . . 0.0 109.104 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.598 ' N ' ' CG ' ' A' ' 94' ' ' GLN . 7.9 tt0 -63.12 -36.45 83.65 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.449 ' SG ' HD23 ' A' ' 134' ' ' LEU . 36.4 t -59.77 -36.27 76.32 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.344 -0.848 . . . . 0.0 109.403 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.18 -35.53 66.41 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.417 -0.802 . . . . 0.0 109.466 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -74.46 -18.29 60.65 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.481 -0.762 . . . . 0.0 109.652 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -121.97 36.8 4.53 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.511 -0.743 . . . . 0.0 109.988 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.0 tpp -59.57 -30.19 68.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.196 -0.94 . . . . 0.0 110.032 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.453 ' O ' ' HB ' ' A' ' 105' ' ' THR . 17.5 m-85 -62.03 -30.04 70.69 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.287 -0.883 . . . . 0.0 109.878 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.5 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -70.34 -40.18 74.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.341 -0.849 . . . . 0.0 110.13 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.493 HG23 ' CE ' ' A' ' 81' ' ' MET . 4.6 t -74.86 -27.84 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.354 -0.841 . . . . 0.0 110.332 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.513 ' O ' ' CG ' ' A' ' 107' ' ' LYS . 2.0 mm100 -88.63 -19.51 26.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.314 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.5 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 11.0 t -67.14 -14.73 63.18 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.17 -0.956 . . . . 0.0 109.985 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.554 ' CD1' HD23 ' A' ' 64' ' ' LEU . 56.6 mt -77.01 -37.82 54.29 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.348 -0.845 . . . . 0.0 110.169 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.523 ' HA ' ' CB ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.276 -0.89 . . . . 0.0 110.085 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.555 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.4 p . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 121.214 0.53 . . . . 0.0 110.213 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.558 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 20.7 m-20 -37.16 -28.77 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.8 -0.562 . . . . 0.0 110.788 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.541 ' CG1' HG12 ' A' ' 74' ' ' VAL . 20.4 t -86.25 -63.06 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.247 -0.908 . . . . 0.0 110.303 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.523 ' CB ' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -41.96 -34.01 0.63 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.154 -0.966 . . . . 0.0 110.935 -179.578 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -82.18 -54.57 5.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.084 -1.01 . . . . 0.0 111.311 -179.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.516 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -50.72 -50.14 56.07 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.969 -1.082 . . . . 0.0 110.338 -179.395 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.443 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -61.22 -42.87 99.36 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.38 -0.825 . . . . 0.0 110.408 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -55.51 -56.52 19.28 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.248 -0.907 . . . . 0.0 110.416 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -44.2 65.4 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.265 -0.897 . . . . 0.0 110.494 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.536 HD23 ' CD1' ' A' ' 85' ' ' ILE . 1.1 tt -56.04 -40.89 74.15 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.115 -0.991 . . . . 0.0 110.134 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.465 HG22 ' HG2' ' A' ' 104' ' ' GLN . 38.6 t -68.13 -24.8 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.369 -0.832 . . . . 0.0 110.031 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -75.81 -51.66 12.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.351 -0.843 . . . . 0.0 110.385 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -35.13 21.52 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 0.0 110.667 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.459 HD13 HG22 ' A' ' 85' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.425 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.062 0.458 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.537 ' CB ' HD12 ' A' ' 46' ' ' LEU . . . -65.93 -46.14 79.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.178 -0.951 . . . . 0.0 110.067 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.438 ' HG3' HG13 ' A' ' 22' ' ' ILE . 12.8 pt-20 -51.97 -28.81 18.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.158 -0.964 . . . . 0.0 110.014 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.438 HG13 ' HG3' ' A' ' 21' ' ' GLU . 64.4 mt -79.34 -47.32 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.292 -0.88 . . . . 0.0 109.992 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.474 ' HB3' HG13 ' A' ' 43' ' ' ILE . 1.8 ttmt -57.91 -30.13 65.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.313 -0.867 . . . . 0.0 110.112 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.523 HG22 HG23 ' A' ' 56' ' ' ILE . 42.4 t -78.96 -41.71 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 109.949 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.491 ' HG2' ' NH1' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -55.59 -42.75 75.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.293 -0.88 . . . . 0.0 109.971 179.88 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -76.21 -30.48 58.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.332 -0.855 . . . . 0.0 110.048 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.505 ' CB ' HD23 ' A' ' 39' ' ' LEU . . . -66.05 -16.03 63.57 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.26 -0.9 . . . . 0.0 110.014 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.479 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 80.7 p . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.242 -0.911 . . . . 0.0 110.137 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.505 HD23 ' CB ' ' A' ' 27' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.24 0.543 . . . . 0.0 110.224 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -58.01 4.0 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.223 -0.923 . . . . 0.0 110.15 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.431 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.9 OUTLIER -44.64 -35.19 2.49 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.321 -0.862 . . . . 0.0 110.168 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.461 ' HB3' ' HD3' ' A' ' 23' ' ' LYS . 29.5 mt-10 -68.4 -56.75 7.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 110.11 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.506 HG21 ' CD2' ' A' ' 84' ' ' LEU . 5.8 mt -48.64 -35.01 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.0 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.538 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . . . -69.75 -51.7 31.79 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.204 -0.935 . . . . 0.0 109.776 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -51.59 -21.74 2.79 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.045 -1.034 . . . . 0.0 109.114 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.537 HD12 ' CB ' ' A' ' 20' ' ' ALA . 21.4 mt -81.35 -38.48 26.58 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.557 -0.715 . . . . 0.0 110.168 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.534 HG22 ' CG2' ' A' ' 92' ' ' VAL . 77.3 p -51.07 -42.39 60.54 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.201 -0.937 . . . . 0.0 109.453 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.514 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 74.9 m-85 -43.82 -45.74 7.5 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.732 -0.787 . . . . 0.0 109.191 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.456 ' O ' ' O ' ' A' ' 48' ' ' TYR . 2.1 t-20 -56.61 -159.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.816 0.817 . . . . 0.0 110.32 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.1 t -124.76 -32.9 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-O 121.52 0.676 . . . . 0.0 109.4 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.574 HG12 ' N ' ' A' ' 52' ' ' ALA . 13.1 t -84.6 -72.72 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 CA-C-O 122.059 0.933 . . . . 0.0 109.816 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.574 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -39.14 -41.02 0.78 Allowed 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.482 -178.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.512 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 27.3 t80 -55.56 -53.78 52.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.467 -0.771 . . . . 0.0 109.839 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.72 -27.22 67.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.284 -0.885 . . . . 0.0 109.985 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -82.98 -19.39 37.17 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.286 -0.884 . . . . 0.0 110.018 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.523 HG23 HG22 ' A' ' 24' ' ' VAL . 11.2 mt -82.09 -68.8 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.694 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.405 ' HE1' ' HB3' ' A' ' 57' ' ' MET . 94.3 mmm -47.27 -34.82 7.03 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.297 -0.877 . . . . 0.0 109.484 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.09 -62.53 1.75 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.432 -0.792 . . . . 0.0 109.85 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.516 ' CB ' HG11 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -57.4 -20.18 28.2 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.268 -0.895 . . . . 0.0 109.763 179.532 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.562 HG21 HD13 ' A' ' 64' ' ' LEU . 0.4 OUTLIER -77.99 -32.99 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.815 . . . . 0.0 109.987 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.564 ' CH2' ' HE2' ' A' ' 81' ' ' MET . 20.4 m95 -76.43 -43.66 39.18 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.905 . . . . 0.0 110.267 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.47 -54.51 46.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.338 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.491 ' NH1' ' HG2' ' A' ' 25' ' ' ARG . 8.4 mtt-85 -69.04 -14.15 62.86 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.23 -0.919 . . . . 0.0 110.184 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.68 HD21 HD13 ' A' ' 106' ' ' LEU . 4.2 mt -77.87 -24.82 48.41 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.215 -0.928 . . . . 0.0 110.189 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 C--N 1.302 -1.488 0 O-C-N 121.417 -0.802 . . . . 0.0 109.806 -179.776 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.47 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 25.1 p-90 . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 121.225 0.536 . . . . 0.0 110.043 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.3 -47.49 36.47 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.092 -1.005 . . . . 0.0 109.983 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.454 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -52.27 -40.15 61.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.235 -0.916 . . . . 0.0 109.984 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.612 ' CG1' ' CG2' ' A' ' 123' ' ' VAL . 49.5 t -63.09 -57.6 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.421 -0.799 . . . . 0.0 110.25 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.582 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 11.2 t80 -44.76 -55.7 5.1 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.456 -0.777 . . . . 0.0 110.161 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 12.3 mmtt -61.71 -31.43 71.58 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.239 -0.913 . . . . 0.0 110.069 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.562 ' HB3' HD23 ' A' ' 64' ' ' LEU . . . -66.98 -24.4 66.04 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.243 -0.91 . . . . 0.0 109.754 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.539 ' HE2' ' CG2' ' A' ' 123' ' ' VAL . 0.3 OUTLIER -79.44 -31.4 42.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.359 -0.838 . . . . 0.0 110.144 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 93.5 m -68.58 -35.33 77.23 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.253 -0.904 . . . . 0.0 110.328 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.523 ' CD2' HD12 ' A' ' 60' ' ' ILE . 30.9 tp -73.25 -36.66 66.42 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.206 -0.934 . . . . 0.0 109.764 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.564 ' HE2' ' CH2' ' A' ' 61' ' ' TRP . 3.6 ttp -71.0 -34.75 71.67 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.167 -0.958 . . . . 0.0 109.823 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.465 ' HB2' HD12 ' A' ' 130' ' ' LEU . 16.4 tt0 -75.72 -36.14 60.05 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.319 -0.863 . . . . 0.0 110.81 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.52 ' CE1' HG23 ' A' ' 87' ' ' THR . 54.0 t80 -72.18 -42.77 65.49 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.168 -0.957 . . . . 0.0 110.455 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.538 ' CD2' ' HA ' ' A' ' 44' ' ' ALA . 53.8 mt -71.42 -29.1 64.5 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.154 -0.966 . . . . 0.0 110.304 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.538 ' CD1' ' O ' ' A' ' 81' ' ' MET . 22.6 mt -64.0 -23.17 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.115 -0.991 . . . . 0.0 109.883 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -98.98 -69.58 0.76 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.946 . . . . 0.0 110.167 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.52 HG23 ' CE1' ' A' ' 83' ' ' TYR . 14.3 t -84.39 -27.18 27.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.253 -0.904 . . . . 0.0 110.238 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.514 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -48.51 -73.42 0.34 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.462 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 7.2 t 174.35 162.91 0.2 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -1.143 . . . . 0.0 110.199 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -62.27 -12.69 22.0 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.274 -0.891 . . . . 0.0 110.199 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.474 ' NH2' ' HG3' ' A' ' 94' ' ' GLN . 5.9 mmp_? -79.01 -43.05 25.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.259 -0.901 . . . . 0.0 110.265 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.534 ' CG2' HG22 ' A' ' 47' ' ' THR . 82.4 t -60.13 -26.0 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.189 -0.944 . . . . 0.0 109.955 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.82 -31.42 23.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.31 -0.869 . . . . 0.0 109.732 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.474 ' HG3' ' NH2' ' A' ' 91' ' ' ARG . 13.3 mm100 -67.95 -48.69 65.18 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.302 -0.874 . . . . 0.0 109.807 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -59.42 -36.88 76.7 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.34 -0.85 . . . . 0.0 109.585 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.418 ' SG ' HD12 ' A' ' 85' ' ' ILE . 44.5 m -56.96 -42.18 79.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.392 -0.817 . . . . 0.0 109.524 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.0 tttp -68.48 -29.07 67.6 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.461 -0.774 . . . . 0.0 109.679 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -83.64 -14.59 51.55 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.387 -0.821 . . . . 0.0 110.077 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -126.21 39.78 3.87 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.364 -0.835 . . . . 0.0 110.271 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 6.1 ttm -65.5 -30.07 70.8 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.186 -0.947 . . . . 0.0 110.206 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.441 ' O ' ' HB ' ' A' ' 105' ' ' THR . 59.7 m-85 -64.39 -12.59 44.29 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.288 -0.883 . . . . 0.0 110.018 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.438 ' O ' HG21 ' A' ' 105' ' ' THR . . . -90.61 -40.67 11.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 110.224 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.53 HG11 ' CG2' ' A' ' 131' ' ' VAL . 2.4 t -75.94 -21.01 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.322 -0.862 . . . . 0.0 109.911 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -91.53 -26.43 18.77 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.373 -0.83 . . . . 0.0 110.316 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.441 ' HB ' ' O ' ' A' ' 101' ' ' TYR . 9.2 t -65.4 -16.04 63.21 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.91 . . . . 0.0 110.177 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.68 HD13 HD21 ' A' ' 64' ' ' LEU . 15.4 mt -70.58 -39.85 73.62 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.283 -0.886 . . . . 0.0 110.336 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.331 -0.855 . . . . 0.0 110.195 179.898 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.0 p . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 121.488 0.661 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.9 OUTLIER -50.88 -49.31 59.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.452 -0.78 . . . . 0.0 110.498 -179.838 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.612 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 9.7 p -77.3 -16.0 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.164 -0.96 . . . . 0.0 110.398 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -66.97 0.78 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.197 -0.939 . . . . 0.0 110.599 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.475 ' CG ' ' N ' ' A' ' 126' ' ' LYS . 13.8 pt-20 -60.02 -43.62 95.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.398 -0.814 . . . . 0.0 110.679 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.582 ' HG3' ' CE1' ' A' ' 75' ' ' TYR . 7.4 tmtm? -54.55 -51.64 64.6 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.125 -0.985 . . . . 0.0 110.161 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.465 ' HA ' ' SD ' ' A' ' 78' ' ' MET . . . -53.99 -41.37 67.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.145 -0.972 . . . . 0.0 110.15 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -58.21 -39.93 80.28 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.226 -0.921 . . . . 0.0 110.041 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 126' ' ' LYS . 7.9 mt-30 -57.3 -48.61 78.5 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.305 -0.872 . . . . 0.0 110.174 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.519 HD11 HD11 ' A' ' 85' ' ' ILE . 9.2 tp -57.59 -28.78 63.92 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.172 -0.955 . . . . 0.0 109.677 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.53 ' CG2' HG11 ' A' ' 103' ' ' VAL . 43.1 t -78.29 -27.9 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.343 -0.848 . . . . 0.0 109.513 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.61 -53.35 12.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.461 -0.774 . . . . 0.0 110.252 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.2 mp -56.13 -32.71 64.48 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.231 -0.918 . . . . 0.0 110.176 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.532 ' CD2' HG22 ' A' ' 85' ' ' ILE . 31.4 mt . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 0.0 110.192 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HG2' ' CD1' ' A' ' 22' ' ' ILE . 38.0 mt-10 . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.216 0.531 . . . . 0.0 110.122 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.434 ' HB3' HD21 ' A' ' 46' ' ' LEU . . . -66.68 -56.54 10.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.265 -0.897 . . . . 0.0 110.221 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.412 ' C ' ' O ' ' A' ' 20' ' ' ALA . 15.1 pt-20 -42.97 -29.55 0.34 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.306 -0.871 . . . . 0.0 110.197 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.529 ' CD1' ' HG2' ' A' ' 19' ' ' GLU . 36.4 mt -79.78 -48.73 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.255 -0.903 . . . . 0.0 110.121 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.462 ' O ' ' HB3' ' A' ' 27' ' ' ALA . 2.6 mmtm -50.46 -35.75 30.34 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 0.0 110.037 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.528 HG23 HG22 ' A' ' 56' ' ' ILE . 98.3 t -72.46 -48.15 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.333 -0.855 . . . . 0.0 110.106 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.71 -51.2 40.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.176 -0.952 . . . . 0.0 110.009 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -65.69 -29.17 69.68 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.936 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.482 ' CB ' ' CD2' ' A' ' 39' ' ' LEU . . . -74.28 -19.51 60.47 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.275 -0.891 . . . . 0.0 110.022 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.528 ' HA ' ' CB ' ' A' ' 76' ' ' LYS . 34.5 p . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.328 -0.858 . . . . 0.0 110.262 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.482 ' CD2' ' CB ' ' A' ' 27' ' ' ALA . 1.3 tp . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.293 0.568 . . . . 0.0 110.234 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.439 ' HE2' HG21 ' A' ' 79' ' ' THR . 8.5 mtt -60.03 -51.9 67.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.157 -0.964 . . . . 0.0 110.195 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 98.0 p -52.78 -26.32 13.97 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.201 -0.937 . . . . 0.0 110.141 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 8.3 mm-40 -78.08 -54.99 5.65 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.251 -0.906 . . . . 0.0 110.2 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.522 HG22 ' CD1' ' A' ' 80' ' ' LEU . 54.6 mt -51.83 -38.11 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.187 -0.945 . . . . 0.0 109.998 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.545 ' HB2' HD21 ' A' ' 84' ' ' LEU . . . -68.61 -53.16 24.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.09 -1.006 . . . . 0.0 109.269 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.458 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 4.9 t70 -51.25 -22.06 2.49 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.13 -0.981 . . . . 0.0 109.147 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.477 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 8.5 mt -80.15 -39.72 28.81 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.5 -0.75 . . . . 0.0 110.053 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.543 HG23 HG22 ' A' ' 92' ' ' VAL . 81.7 p -48.54 -38.98 21.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.094 -1.004 . . . . 0.0 109.26 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.585 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 63.3 m-85 -45.28 -49.62 12.45 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.401 -0.92 . . . . 0.0 109.442 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.544 ' O ' ' C ' ' A' ' 50' ' ' VAL . 49.2 m-20 -70.49 92.29 0.82 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.672 -0.642 . . . . 0.0 110.8 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.544 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -12.16 -57.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.21 178.095 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.551 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.6 t -62.54 -64.85 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.07 -1.019 . . . . 0.0 109.888 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.551 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -38.03 -40.98 0.53 Allowed 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.302 0.572 . . . . 0.0 110.568 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.583 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 29.1 t80 -64.81 -57.48 8.77 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.453 -0.779 . . . . 0.0 110.265 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -26.82 9.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.213 -0.929 . . . . 0.0 110.016 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -84.17 -31.72 24.99 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.238 -0.914 . . . . 0.0 109.981 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.528 HG22 HG23 ' A' ' 24' ' ' VAL . 17.0 mt -74.66 -68.48 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.396 -0.815 . . . . 0.0 110.117 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.583 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 14.1 mmm -43.8 -38.83 3.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.267 -0.896 . . . . 0.0 109.729 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.83 -59.87 3.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.394 -0.816 . . . . 0.0 109.951 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 16.4 mmt -60.11 -21.94 62.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.263 -0.898 . . . . 0.0 109.896 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.522 HD11 HD21 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -76.92 -28.28 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.425 -0.797 . . . . 0.0 109.878 179.898 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 14.4 m95 -81.99 -29.54 32.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.276 -0.89 . . . . 0.0 110.373 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -58.54 3.4 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.378 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -64.57 -24.02 67.46 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.185 -0.947 . . . . 0.0 110.139 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.594 HD21 ' CD1' ' A' ' 106' ' ' LEU . 5.6 mt -66.14 -16.28 63.83 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.0 110.392 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.9 m-20 . . . . . 0 C--N 1.302 -1.461 0 O-C-N 121.293 -0.879 . . . . 0.0 110.058 -179.528 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.428 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 19.6 p-90 . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.168 0.509 . . . . 0.0 110.381 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 39.2 mtt85 -48.93 -46.21 42.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.107 -0.996 . . . . 0.0 110.092 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 -58.73 -48.88 79.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.227 -0.92 . . . . 0.0 110.107 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.538 ' CG1' HG13 ' A' ' 123' ' ' VAL . 16.9 t -46.62 -44.72 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.269 -0.895 . . . . 0.0 110.181 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.489 ' O ' ' SD ' ' A' ' 78' ' ' MET . 4.0 t80 -55.72 -54.87 39.02 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.251 -0.906 . . . . 0.0 110.283 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.528 ' CB ' ' HA ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -71.17 -9.11 57.52 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.898 -1.126 . . . . 0.0 109.52 179.525 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.555 ' HB3' ' CD2' ' A' ' 64' ' ' LEU . . . -79.16 -70.2 0.52 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.395 -0.815 . . . . 0.0 110.941 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.544 ' CE ' HG11 ' A' ' 123' ' ' VAL . 0.7 OUTLIER -56.63 -26.7 56.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.114 -0.991 . . . . 0.0 110.105 -179.487 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.44 ' OG1' ' O ' ' A' ' 75' ' ' TYR . 61.2 m -63.65 -65.2 0.71 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.031 -1.043 . . . . 0.0 109.439 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.552 HD11 ' CD2' ' A' ' 84' ' ' LEU . 10.6 tp -42.67 -59.0 2.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.502 -0.748 . . . . 0.0 109.316 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.476 ' O ' HG13 ' A' ' 85' ' ' ILE . 19.4 ttt -42.9 -46.08 5.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.359 -0.838 . . . . 0.0 109.836 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.52 ' CA ' HD13 ' A' ' 130' ' ' LEU . 40.8 tt0 -58.81 -48.57 80.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.356 -0.84 . . . . 0.0 109.779 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.444 ' HB3' HD23 ' A' ' 84' ' ' LEU . 22.9 t80 -54.48 -37.39 65.2 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.41 -0.806 . . . . 0.0 110.183 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.552 ' CD2' HD11 ' A' ' 80' ' ' LEU . 2.6 mt -74.67 -28.45 60.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.273 -0.892 . . . . 0.0 110.007 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.533 ' CD1' HD21 ' A' ' 130' ' ' LEU . 32.2 mt -70.22 -26.05 28.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.037 -1.039 . . . . 0.0 109.962 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -88.77 -68.68 0.75 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.261 -0.9 . . . . 0.0 110.383 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.454 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 14.5 t -95.1 -22.73 17.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.201 -0.937 . . . . 0.0 110.49 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.585 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -47.68 -77.17 0.12 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.466 ' HB3' ' O ' ' A' ' 88' ' ' GLY . 6.2 p -178.71 171.45 1.48 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.169 -1.195 . . . . 0.0 110.301 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -71.47 -13.8 61.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.272 -0.892 . . . . 0.0 110.219 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 15.7 mmt180 -79.48 -41.51 27.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.25 -0.906 . . . . 0.0 109.989 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.577 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 93.3 t -56.26 -33.24 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.263 -0.898 . . . . 0.0 109.865 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.455 ' O ' ' HB3' ' A' ' 96' ' ' CYS . 1.6 t -76.15 -40.97 51.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.289 -0.882 . . . . 0.0 109.849 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -57.18 -56.58 19.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -0.869 . . . . 0.0 109.861 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -52.92 -38.75 62.22 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.361 -0.837 . . . . 0.0 109.568 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.455 ' HB3' ' O ' ' A' ' 93' ' ' SER . 48.9 t -54.67 -43.84 72.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.359 -0.838 . . . . 0.0 109.693 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -65.44 -35.81 82.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.352 -0.842 . . . . 0.0 109.675 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -78.24 -12.68 60.01 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.421 -0.799 . . . . 0.0 109.842 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -134.04 30.41 3.65 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.458 -0.776 . . . . 0.0 110.119 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 4.9 ptt? -62.99 -24.92 68.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.178 -0.951 . . . . 0.0 110.009 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.46 ' O ' ' HB ' ' A' ' 105' ' ' THR . 2.7 m-85 -65.76 -23.84 66.82 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.213 -0.929 . . . . 0.0 109.99 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.519 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -78.37 -40.89 34.91 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.381 -0.825 . . . . 0.0 110.193 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.46 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 5.3 t -72.17 -27.64 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.306 -0.871 . . . . 0.0 110.151 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -86.84 -29.36 22.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.327 -0.858 . . . . 0.0 110.372 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.519 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 11.0 t -57.59 -19.38 25.45 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.236 -0.915 . . . . 0.0 110.232 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.594 ' CD1' HD21 ' A' ' 64' ' ' LEU . 20.4 mt -68.97 -40.65 78.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.251 -0.906 . . . . 0.0 110.255 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 14.9 ttpp . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.235 -0.916 . . . . 0.0 110.196 179.836 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.564 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.2 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.282 0.563 . . . . 0.0 110.071 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.564 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.6 m-80 -36.6 -30.11 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.218 0.533 . . . . 0.0 110.64 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.544 HG11 ' CE ' ' A' ' 78' ' ' MET . 12.6 t -72.7 -62.12 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.339 -0.851 . . . . 0.0 110.283 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -44.47 -43.82 8.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.251 -0.905 . . . . 0.0 110.658 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.525 ' HG3' ' N ' ' A' ' 126' ' ' LYS . 10.0 pt-20 -75.39 -32.22 60.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.276 -0.89 . . . . 0.0 110.717 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.525 ' N ' ' HG3' ' A' ' 125' ' ' GLU . 33.4 tptt -62.07 -52.89 62.08 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.97 -1.081 . . . . 0.0 110.247 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.46 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -58.26 -41.42 84.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.302 -0.874 . . . . 0.0 110.267 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 11.6 tttm -59.67 -38.29 81.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.23 -0.919 . . . . 0.0 110.305 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -62.32 -40.62 96.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.281 -0.887 . . . . 0.0 110.6 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.533 HD21 ' CD1' ' A' ' 85' ' ' ILE . 7.9 tt -61.17 -40.39 93.71 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.08 -1.012 . . . . 0.0 110.508 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.411 HG21 HG12 ' A' ' 103' ' ' VAL . 54.0 t -77.45 -24.96 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.321 -0.862 . . . . 0.0 110.475 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.0 -52.61 18.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.234 -0.916 . . . . 0.0 110.573 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.491 ' C ' ' CD1' ' A' ' 133' ' ' LEU . 3.5 pp -66.31 -22.16 66.28 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.181 -0.95 . . . . 0.0 110.371 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.528 HD12 ' CG2' ' A' ' 85' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 O-C-N 121.268 -0.895 . . . . 0.0 110.466 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 121.242 0.544 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.513 ' CB ' HD11 ' A' ' 46' ' ' LEU . . . -60.42 -45.58 93.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.266 -0.896 . . . . 0.0 110.286 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.459 ' HG3' HG13 ' A' ' 22' ' ' ILE . 9.4 pt-20 -43.39 -40.94 3.93 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 110.051 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.524 HG21 HD13 ' A' ' 22' ' ' ILE . 37.3 mt -69.45 -40.46 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.2 -0.938 . . . . 0.0 109.968 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.53 -61.72 2.41 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.287 -0.883 . . . . 0.0 110.122 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.523 HG22 HG23 ' A' ' 56' ' ' ILE . 84.2 t -48.35 -33.33 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.241 -0.912 . . . . 0.0 110.052 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.402 ' HB3' ' O ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER -64.6 -46.39 82.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.374 -0.829 . . . . 0.0 110.244 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.01 -17.13 61.03 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.384 -0.822 . . . . 0.0 110.19 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.553 ' CB ' ' CD2' ' A' ' 39' ' ' LEU . . . -79.7 -28.1 40.67 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 110.152 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.41 HG23 ' HA ' ' A' ' 77' ' ' ALA . 77.4 p . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.24 -0.912 . . . . 0.0 110.142 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.553 ' CD2' ' CB ' ' A' ' 27' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.27 0.557 . . . . 0.0 110.18 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.0 mtp -66.99 -52.36 43.57 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.275 -0.891 . . . . 0.0 110.149 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 t -55.04 -32.08 61.6 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.269 -0.894 . . . . 0.0 110.221 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.94 -46.4 52.7 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.257 -0.902 . . . . 0.0 110.218 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.459 ' O ' ' HB2' ' A' ' 46' ' ' LEU . 68.6 mt -59.81 -31.01 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.129 -0.982 . . . . 0.0 109.853 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.552 ' HB1' HD21 ' A' ' 84' ' ' LEU . . . -70.65 -51.43 27.94 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.135 -0.978 . . . . 0.0 109.434 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.406 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 38.4 t0 -52.68 -21.08 3.6 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.076 -1.015 . . . . 0.0 108.886 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.525 ' O ' ' CB ' ' A' ' 52' ' ' ALA . 15.5 mt -79.81 -38.31 33.23 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.488 -0.757 . . . . 0.0 110.247 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.518 ' HA ' ' CA ' ' A' ' 53' ' ' PHE . 55.3 p -52.49 -45.41 66.15 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.946 -1.096 . . . . 0.0 109.063 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.463 ' OH ' ' O ' ' A' ' 87' ' ' THR . 90.4 m-85 -43.58 -41.98 4.84 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.38 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.535 ' O ' ' N ' ' A' ' 51' ' ' VAL . 0.3 OUTLIER -73.51 91.43 1.81 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.577 -0.702 . . . . 0.0 110.183 179.531 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.532 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.09 -59.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.571 178.309 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.556 HG11 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -65.05 -65.78 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.104 -0.998 . . . . 0.0 110.203 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.556 ' N ' HG11 ' A' ' 51' ' ' VAL . . . -35.64 -46.56 0.43 Allowed 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.099 -177.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.518 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 4.7 t80 -55.4 -56.75 16.58 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.279 -0.888 . . . . 0.0 110.289 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 58' ' ' SER . 88.9 p -52.1 -38.88 58.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.206 -0.934 . . . . 0.0 110.245 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -70.14 -29.73 66.73 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.431 -0.793 . . . . 0.0 110.39 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.523 HG23 HG22 ' A' ' 24' ' ' VAL . 11.2 mt -77.55 -70.28 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.187 -0.946 . . . . 0.0 110.281 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.516 ' HG3' ' NE1' ' A' ' 61' ' ' TRP . 1.9 tpt -47.19 -34.6 6.48 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.144 -0.972 . . . . 0.0 110.031 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.46 ' HB2' ' O ' ' A' ' 54' ' ' SER . 32.5 t -57.23 -61.82 2.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.333 -0.854 . . . . 0.0 110.108 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.4 mmt -58.21 -26.62 63.06 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.199 -0.938 . . . . 0.0 109.941 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.567 HG23 HD13 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -71.6 -31.07 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.299 -0.876 . . . . 0.0 109.88 179.747 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.516 ' NE1' ' HG3' ' A' ' 57' ' ' MET . 11.0 m95 -77.47 -42.93 34.07 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.277 -0.889 . . . . 0.0 110.386 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -60.5 3.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.283 -0.886 . . . . 0.0 110.605 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -13.04 57.96 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.187 -0.946 . . . . 0.0 110.578 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.607 HD21 ' CD1' ' A' ' 106' ' ' LEU . 2.4 mt -74.99 -13.43 60.51 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.162 -0.961 . . . . 0.0 110.576 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 . . . . . 0 C--N 1.303 -1.456 0 O-C-N 121.15 -0.969 . . . . 0.0 110.379 -179.625 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.462 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 33.7 p-90 . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.273 0.559 . . . . 0.0 110.096 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.444 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 14.9 mtt180 -50.69 -42.98 57.46 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.242 -0.911 . . . . 0.0 109.945 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.3 m170 -54.56 -39.62 67.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.321 -0.862 . . . . 0.0 109.835 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.535 ' CG1' HG12 ' A' ' 123' ' ' VAL . 42.7 t -60.64 -51.27 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.314 -0.866 . . . . 0.0 109.759 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 74' ' ' VAL . 2.2 t80 -41.79 -61.55 1.08 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.393 -0.817 . . . . 0.0 110.261 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.03 -28.98 70.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.271 -0.893 . . . . 0.0 110.195 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.551 ' HB3' HD23 ' A' ' 64' ' ' LEU . . . -61.24 -70.32 0.19 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.185 -0.947 . . . . 0.0 110.166 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.525 ' CE ' HG13 ' A' ' 123' ' ' VAL . 3.0 ptp -50.49 -26.61 5.33 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.398 -0.814 . . . . 0.0 110.023 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 75' ' ' TYR . 61.2 m -66.68 -47.27 72.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.272 -0.892 . . . . 0.0 109.937 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.53 HD23 HD11 ' A' ' 60' ' ' ILE . 16.6 tp -64.22 -29.7 70.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.428 -0.795 . . . . 0.0 109.838 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.504 ' O ' ' CG1' ' A' ' 85' ' ' ILE . 5.2 ttp -71.86 -35.17 69.74 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.333 -0.854 . . . . 0.0 109.893 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.469 ' HB2' HD12 ' A' ' 130' ' ' LEU . 46.2 tt0 -70.87 -56.41 6.34 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.298 -0.876 . . . . 0.0 110.22 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -52.56 -45.06 66.25 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.289 -0.882 . . . . 0.0 110.74 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.552 HD21 ' HB1' ' A' ' 44' ' ' ALA . 59.8 mt -73.0 -29.68 63.21 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.935 . . . . 0.0 110.791 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.557 HG23 ' CD2' ' A' ' 134' ' ' LEU . 8.5 mt -61.19 -14.28 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 120.859 -1.151 . . . . 0.0 109.635 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 43.0 mttt -107.03 -77.76 0.59 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.241 -0.912 . . . . 0.0 109.97 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.463 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 13.5 t -82.49 2.88 30.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.881 . . . . 0.0 110.019 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.557 ' O ' ' CB ' ' A' ' 89' ' ' SER . . . -93.39 30.06 7.66 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.2 OUTLIER 75.74 148.59 0.1 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.58 -0.953 . . . . 0.0 110.41 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.3 -9.72 13.01 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.48 -0.763 . . . . 0.0 110.542 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 -71.46 -43.13 67.19 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.184 -0.948 . . . . 0.0 109.836 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.545 ' CG2' ' O ' ' A' ' 88' ' ' GLY . 99.3 t -55.98 -32.85 34.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.481 -0.762 . . . . 0.0 110.324 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.446 ' HA ' HG12 ' A' ' 85' ' ' ILE . 1.1 t -81.56 -41.81 21.05 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.239 -0.913 . . . . 0.0 110.27 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -55.12 -54.18 46.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.0 109.961 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.442 ' HG2' ' HE2' ' A' ' 57' ' ' MET . 11.1 tt0 -54.18 -39.46 66.62 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.408 -0.807 . . . . 0.0 109.657 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.465 ' SG ' ' CD1' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -55.26 -43.01 74.27 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.318 -0.864 . . . . 0.0 109.644 179.527 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -68.12 -31.22 70.66 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.435 -0.791 . . . . 0.0 109.704 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -75.62 -19.84 58.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.432 -0.793 . . . . 0.0 109.798 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -122.07 40.67 3.59 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.411 -0.806 . . . . 0.0 110.033 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.468 ' O ' ' HB2' ' A' ' 104' ' ' GLN . 0.2 OUTLIER -56.15 -22.64 29.92 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.27 -0.894 . . . . 0.0 110.343 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.431 ' N ' ' HG2' ' A' ' 100' ' ' MET . 2.3 m-30 -76.57 -32.26 58.06 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -0.916 . . . . 0.0 110.256 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.529 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -74.5 -39.41 62.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 110.219 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.568 ' CG1' ' N ' ' A' ' 104' ' ' GLN . 3.2 p -74.26 -42.43 50.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 O-C-N 121.287 -0.883 . . . . 0.0 109.304 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.568 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 67.3 mt-30 -71.94 -20.16 61.8 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.596 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.529 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 5.1 t -53.34 -28.28 27.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.951 -1.093 . . . . 0.0 110.056 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.607 ' CD1' HD21 ' A' ' 64' ' ' LEU . 75.5 mt -71.94 -35.32 69.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.874 . . . . 0.0 110.263 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.452 ' HA ' ' HG2' ' A' ' 124' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.625 0 O-C-N 121.234 -0.916 . . . . 0.0 110.087 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.563 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.7 p . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.301 0.572 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.563 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.2 m-20 -37.43 -28.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.76 -0.588 . . . . 0.0 110.76 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.535 HG12 ' CG1' ' A' ' 74' ' ' VAL . 7.1 t -85.29 -64.73 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.243 -0.91 . . . . 0.0 110.211 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.452 ' HG2' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -40.6 -36.27 0.57 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.146 -0.971 . . . . 0.0 111.05 -179.467 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 128' ' ' LYS . 17.5 mm-40 -81.36 -50.81 9.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.119 -0.988 . . . . 0.0 111.191 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.464 ' HB3' ' SD ' ' A' ' 78' ' ' MET . 0.0 OUTLIER -53.59 -56.78 14.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.075 -1.016 . . . . 0.0 109.73 -179.786 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.494 ' N ' ' SD ' ' A' ' 78' ' ' MET . . . -53.78 -41.36 67.16 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.398 -0.814 . . . . 0.0 110.058 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.453 ' HB3' ' O ' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -50.78 -40.7 55.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.125 -0.984 . . . . 0.0 110.175 179.917 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -65.21 -53.1 49.64 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 110.177 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.528 HD11 ' CD1' ' A' ' 85' ' ' ILE . 17.1 tp -48.58 -32.03 7.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.216 -0.928 . . . . 0.0 110.13 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.468 HG22 HG22 ' A' ' 103' ' ' VAL . 21.4 t -78.73 -35.05 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.391 -0.818 . . . . 0.0 110.106 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.78 -52.71 55.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 0.0 110.185 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.19 -44.6 83.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.3 -0.875 . . . . 0.0 110.186 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.557 ' CD2' HG23 ' A' ' 85' ' ' ILE . 5.9 mt . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.246 -0.909 . . . . 0.0 110.346 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.283 0.563 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.475 ' CB ' HD12 ' A' ' 46' ' ' LEU . . . -72.46 -42.35 65.07 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.186 -0.946 . . . . 0.0 110.265 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.457 ' HG3' HG12 ' A' ' 22' ' ' ILE . 17.2 pt-20 -43.23 -34.41 1.15 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.257 -0.902 . . . . 0.0 110.01 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.457 HG12 ' HG3' ' A' ' 21' ' ' GLU . 25.0 mm -79.83 -50.24 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.383 -0.823 . . . . 0.0 109.811 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.532 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 4.1 mptt -48.76 -27.99 3.33 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.281 -0.887 . . . . 0.0 110.096 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.552 HG23 HG23 ' A' ' 56' ' ' ILE . 91.6 t -85.42 -33.62 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.263 -0.898 . . . . 0.0 110.014 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -62.87 -43.27 99.24 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.249 -0.907 . . . . 0.0 109.921 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -33.31 61.76 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.484 -0.76 . . . . 0.0 110.061 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.585 ' HB3' HD21 ' A' ' 39' ' ' LEU . . . -64.57 -23.17 67.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.333 -0.854 . . . . 0.0 110.13 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.463 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 40.7 p . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.241 -0.912 . . . . 0.0 110.223 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.585 HD21 ' HB3' ' A' ' 27' ' ' ALA . 4.5 tp . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 121.157 0.503 . . . . 0.0 110.712 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 2.9 mtt -96.71 -43.7 7.43 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.186 -0.946 . . . . 0.0 109.869 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.0 t -67.33 -28.8 68.28 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.334 -0.854 . . . . 0.0 110.374 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.46 ' OE1' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -73.4 -50.37 22.17 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.25 -0.906 . . . . 0.0 110.359 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.532 ' CG1' ' HB3' ' A' ' 23' ' ' LYS . 20.9 mt -56.34 -36.62 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.234 -0.916 . . . . 0.0 110.272 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.498 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.05 -48.49 57.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.064 -1.023 . . . . 0.0 109.486 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.43 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -53.49 -20.68 5.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.047 -1.033 . . . . 0.0 108.995 178.856 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.475 ' O ' ' HB1' ' A' ' 52' ' ' ALA . 15.6 mt -81.5 -36.91 28.69 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.499 -0.751 . . . . 0.0 109.884 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.485 ' OG1' ' O ' ' A' ' 44' ' ' ALA . 67.9 p -51.92 -43.42 63.41 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.269 -0.972 . . . . 0.0 109.038 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.43 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 93.4 m-85 -45.02 -43.3 9.11 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.433 -0.907 . . . . 0.0 109.399 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 50' ' ' VAL . 0.8 OUTLIER -71.78 90.47 1.09 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.551 -0.718 . . . . 0.0 110.51 179.631 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.02 -58.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.609 178.175 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.564 HG11 ' N ' ' A' ' 52' ' ' ALA . 3.0 t -66.11 -66.26 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.052 -1.03 . . . . 0.0 110.345 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.564 ' N ' HG11 ' A' ' 51' ' ' VAL . . . -35.46 -42.9 0.23 Allowed 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.16 0.505 . . . . 0.0 110.833 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.599 ' CE1' ' HA ' ' A' ' 92' ' ' VAL . 32.0 t80 -58.91 -55.16 38.69 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.413 -0.804 . . . . 0.0 110.21 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.7 t -53.92 -28.18 35.34 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.316 -0.865 . . . . 0.0 109.924 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.38 -30.37 37.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.297 -0.877 . . . . 0.0 109.997 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.552 HG23 HG23 ' A' ' 24' ' ' VAL . 6.7 mt -75.89 -65.8 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.398 -0.814 . . . . 0.0 109.963 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.573 ' CG ' ' CE1' ' A' ' 53' ' ' PHE . 89.4 mmm -45.94 -34.49 3.97 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.21 -0.931 . . . . 0.0 109.792 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.6 m -57.7 -63.99 1.05 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.333 -0.854 . . . . 0.0 110.108 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.46 ' HB3' HG13 ' A' ' 24' ' ' VAL . 0.4 OUTLIER -57.93 -20.21 35.78 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.946 . . . . 0.0 110.104 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.561 HG23 HD12 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -79.67 -30.6 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.337 -0.852 . . . . 0.0 109.979 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.56 ' CD1' ' O ' ' A' ' 57' ' ' MET . 21.6 m95 -80.94 -44.74 17.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.162 -0.962 . . . . 0.0 110.162 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.73 -44.37 85.95 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.289 -0.882 . . . . 0.0 109.813 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.416 ' O ' HG22 ' A' ' 74' ' ' VAL . 2.8 mmt85 -73.75 -14.42 61.12 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.0 109.942 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.62 HD22 ' CD1' ' A' ' 106' ' ' LEU . 10.1 mt -85.0 -19.49 31.94 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.304 -0.872 . . . . 0.0 110.312 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.404 0 O-C-N 121.247 -0.908 . . . . 0.0 110.141 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.562 ' CZ3' ' HA ' ' A' ' 72' ' ' ARG . 21.7 p-90 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.116 0.484 . . . . 0.0 110.12 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.562 ' HA ' ' CZ3' ' A' ' 71' ' ' TRP . 11.8 ptm180 -42.83 -33.18 0.72 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.309 -0.87 . . . . 0.0 110.138 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.418 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 0.6 OUTLIER -68.28 -48.58 64.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.197 -0.939 . . . . 0.0 109.961 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.537 HG11 ' CG1' ' A' ' 123' ' ' VAL . 79.5 t -53.53 -50.78 47.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 0.0 109.978 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.629 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 2.8 t80 -50.42 -58.97 4.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.215 -0.928 . . . . 0.0 109.979 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.463 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 4.9 mttt -56.62 -25.3 52.72 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.363 -0.836 . . . . 0.0 110.09 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.538 ' HB3' HD21 ' A' ' 64' ' ' LEU . . . -73.85 -34.19 64.4 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.89 . . . . 0.0 110.207 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.537 ' HE1' HG13 ' A' ' 74' ' ' VAL . 0.4 OUTLIER -65.59 -34.73 78.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.346 -0.846 . . . . 0.0 110.029 179.841 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 44.5 m -67.99 -59.68 3.08 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 110.317 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.527 ' CD1' HD11 ' A' ' 84' ' ' LEU . 25.6 tp -47.51 -55.1 9.82 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.31 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.52 ' HG2' ' CD2' ' A' ' 130' ' ' LEU . 2.0 tpt -51.3 -35.57 38.4 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.113 -0.992 . . . . 0.0 110.29 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.518 ' HB2' ' CD1' ' A' ' 130' ' ' LEU . 26.4 tt0 -71.31 -64.86 0.83 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.183 -0.948 . . . . 0.0 110.418 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.596 ' CE1' ' CG2' ' A' ' 87' ' ' THR . 45.3 t80 -43.8 -38.05 3.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.207 -0.933 . . . . 0.0 110.955 -179.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.537 ' CB ' HG11 ' A' ' 92' ' ' VAL . 68.8 mt -76.81 -34.36 57.94 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.124 -0.985 . . . . 0.0 110.751 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.544 ' N ' HG13 ' A' ' 92' ' ' VAL . 10.6 mt -50.89 -21.2 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.924 -1.11 . . . . 0.0 109.722 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.69 -77.45 0.57 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.232 -0.917 . . . . 0.0 110.156 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.596 ' CG2' ' CE1' ' A' ' 83' ' ' TYR . 13.0 t -61.85 -13.92 28.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.251 -0.906 . . . . 0.0 110.147 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.52 ' O ' ' CG2' ' A' ' 92' ' ' VAL . . . -88.82 30.9 5.19 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.495 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 71.47 157.15 0.17 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.318 -1.107 . . . . 0.0 110.431 179.961 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -66.95 -7.19 20.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.424 -0.798 . . . . 0.0 110.485 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -73.09 -40.38 65.05 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 0.0 109.714 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.599 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 86.8 t -61.09 -35.15 63.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.315 -0.866 . . . . 0.0 109.855 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.4 t -75.51 -43.84 46.87 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.156 -0.965 . . . . 0.0 109.678 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -56.79 -37.5 71.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.0 109.603 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.402 ' HG2' ' HE1' ' A' ' 57' ' ' MET . 8.2 tp-100 -65.22 -41.51 94.37 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.348 -0.845 . . . . 0.0 109.288 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.409 ' SG ' ' HG ' ' A' ' 134' ' ' LEU . 4.6 t -54.22 -42.21 69.55 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.333 -0.854 . . . . 0.0 109.236 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.448 ' HA ' ' HE2' ' A' ' 100' ' ' MET . 0.6 OUTLIER -65.59 -34.17 77.6 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.505 -0.747 . . . . 0.0 109.351 179.283 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -78.77 -13.68 59.68 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.532 -0.73 . . . . 0.0 109.702 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -134.51 35.52 3.18 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.461 -0.774 . . . . 0.0 110.017 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.448 ' HE2' ' HA ' ' A' ' 97' ' ' LYS . 1.8 mtm -63.04 -28.44 70.1 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.245 -0.91 . . . . 0.0 110.133 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.459 ' O ' ' HB ' ' A' ' 105' ' ' THR . 44.0 m-85 -63.04 -22.66 67.01 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -0.89 . . . . 0.0 109.935 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.496 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -77.56 -41.12 40.07 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.309 -0.869 . . . . 0.0 110.069 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.458 HG11 HD21 ' A' ' 130' ' ' LEU . 3.4 t -74.75 -26.46 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.392 -0.817 . . . . 0.0 109.967 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.473 ' HG2' HG21 ' A' ' 131' ' ' VAL . 17.4 mm100 -85.64 -25.96 26.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.303 -0.873 . . . . 0.0 110.153 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.515 HG22 ' N ' ' A' ' 106' ' ' LEU . 7.5 t -62.19 -23.88 66.87 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.241 -0.912 . . . . 0.0 110.154 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.62 ' CD1' HD22 ' A' ' 64' ' ' LEU . 13.5 mt -65.03 -40.51 94.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.186 -0.946 . . . . 0.0 110.177 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.7 ttpp . . . . . 0 N--CA 1.49 1.575 0 O-C-N 121.181 -0.949 . . . . 0.0 109.884 179.867 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.563 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.2 p . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 121.473 0.654 . . . . 0.0 110.376 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.577 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 3.1 m-80 -46.26 -31.41 2.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.213 -0.929 . . . . 0.0 110.258 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.537 ' CG1' HG11 ' A' ' 74' ' ' VAL . 2.0 t -83.13 -55.2 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.25 -0.906 . . . . 0.0 110.361 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.422 ' N ' HG11 ' A' ' 123' ' ' VAL . 2.2 tmt_? -47.74 -49.78 27.32 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.009 -1.057 . . . . 0.0 111.073 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -64.85 -53.22 50.2 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.257 -0.902 . . . . 0.0 111.505 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.629 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -50.13 -45.43 52.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.982 -1.074 . . . . 0.0 110.682 -179.242 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.423 ' HB2' ' HE2' ' A' ' 78' ' ' MET . . . -67.24 -42.93 83.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.22 -0.925 . . . . 0.0 110.396 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -45.9 -55.99 6.01 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.184 -0.948 . . . . 0.0 110.276 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -58.56 -51.1 71.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 0.0 110.333 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.542 HD12 ' CD1' ' A' ' 85' ' ' ILE . 25.6 tp -46.09 -27.78 1.04 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.246 -0.909 . . . . 0.0 110.316 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.473 HG21 ' HG2' ' A' ' 104' ' ' GLN . 25.6 t -89.87 -33.87 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.208 -0.933 . . . . 0.0 110.284 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.82 -58.26 6.04 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.23 -0.919 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.6 tt -51.63 -39.5 58.2 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.22 -0.925 . . . . 0.0 110.241 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.517 HD21 HG23 ' A' ' 85' ' ' ILE . 2.9 mm? . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 110.182 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.174 0.512 . . . . 0.0 110.305 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.568 ' HB3' HD21 ' A' ' 46' ' ' LEU . . . -64.67 -44.52 90.1 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.266 -0.896 . . . . 0.0 110.178 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -55.52 -42.87 75.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.177 -0.952 . . . . 0.0 110.292 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mm -63.68 -53.87 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.288 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.455 ' HB3' HG13 ' A' ' 43' ' ' ILE . 28.7 mmtm -50.74 -58.97 4.62 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.207 -0.933 . . . . 0.0 110.349 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.529 ' CG2' HG21 ' A' ' 56' ' ' ILE . 38.2 t -45.0 -44.52 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.0 110.447 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -38.64 91.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.118 -0.989 . . . . 0.0 110.334 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -72.03 -20.66 61.66 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.322 -0.861 . . . . 0.0 110.055 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.524 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -86.81 -15.94 37.7 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.198 -0.939 . . . . 0.0 110.05 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.451 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 14.0 p . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.33 -0.856 . . . . 0.0 110.102 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.524 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 1.6 tp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.259 0.552 . . . . 0.0 110.209 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.4 ' HE3' ' CG2' ' A' ' 79' ' ' THR . 0.0 OUTLIER -60.82 -60.68 3.41 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.221 -0.925 . . . . 0.0 110.264 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.573 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 14.1 m -46.87 -28.29 1.53 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.202 -0.936 . . . . 0.0 110.216 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HB3' ' O ' ' A' ' 39' ' ' LEU . 19.5 tp10 -71.92 -50.74 26.51 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.305 -0.872 . . . . 0.0 110.249 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.524 HG23 ' CD2' ' A' ' 84' ' ' LEU . 8.1 mt -54.91 -31.46 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.137 -0.977 . . . . 0.0 110.03 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.563 ' HB1' HD23 ' A' ' 84' ' ' LEU . . . -70.48 -53.4 16.42 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.248 -0.908 . . . . 0.0 109.547 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.49 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER -53.15 -20.88 4.28 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.02 -1.05 . . . . 0.0 109.044 179.112 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.568 HD21 ' HB3' ' A' ' 20' ' ' ALA . 11.0 mt -80.66 -37.16 31.4 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.522 -0.736 . . . . 0.0 110.108 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.544 ' HA ' ' CA ' ' A' ' 53' ' ' PHE . 68.8 p -53.54 -43.14 68.17 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.031 -1.043 . . . . 0.0 109.29 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.49 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 92.6 m-85 -43.57 -41.23 4.43 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.394 -0.816 . . . . 0.0 109.523 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.536 ' O ' ' N ' ' A' ' 51' ' ' VAL . 0.5 OUTLIER -74.69 93.1 2.51 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.427 -0.796 . . . . 0.0 110.247 179.459 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.532 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.42 -57.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.535 178.262 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.554 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.8 t -64.48 -65.69 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.018 -1.051 . . . . 0.0 110.359 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.554 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -37.84 -48.87 1.16 Allowed 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.051 -177.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.544 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 2.6 t80 -55.15 -53.32 57.46 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.198 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.455 ' O ' ' HB2' ' A' ' 58' ' ' SER . 1.1 t -57.41 -26.31 60.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.179 -0.951 . . . . 0.0 110.416 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -87.58 -20.45 26.4 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.171 -0.955 . . . . 0.0 110.492 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.529 HG21 ' CG2' ' A' ' 24' ' ' VAL . 10.8 mt -78.99 -70.09 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.192 -0.942 . . . . 0.0 110.316 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.511 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 9.6 mtp -50.92 -36.79 40.24 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.174 -0.954 . . . . 0.0 109.897 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.455 ' HB2' ' O ' ' A' ' 54' ' ' SER . 42.3 t -54.37 -59.99 3.95 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.274 -0.891 . . . . 0.0 109.761 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -58.83 -28.9 66.48 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.336 -0.852 . . . . 0.0 109.587 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.557 HG23 HD12 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -66.99 -31.65 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.458 -0.776 . . . . 0.0 109.624 179.699 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.56 ' CH2' ' HE2' ' A' ' 81' ' ' MET . 41.6 m95 -76.04 -47.41 24.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.183 -0.948 . . . . 0.0 110.191 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -49.86 -61.9 1.87 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.347 -0.845 . . . . 0.0 110.393 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 20.4 mmt-85 -64.27 -19.84 65.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.244 -0.91 . . . . 0.0 110.19 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.579 ' CD2' ' CD1' ' A' ' 106' ' ' LEU . 3.2 mt -70.73 -20.41 62.64 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.169 -0.957 . . . . 0.0 110.332 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 . . . . . 0 C--N 1.305 -1.362 0 O-C-N 121.188 -0.945 . . . . 0.0 110.218 -179.855 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.557 ' CZ3' ' HG3' ' A' ' 72' ' ' ARG . 46.1 p-90 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.212 0.529 . . . . 0.0 110.308 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.557 ' HG3' ' CZ3' ' A' ' 71' ' ' TRP . 0.9 OUTLIER -53.75 -42.01 67.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.208 -0.933 . . . . 0.0 110.232 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.451 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 27.5 m170 -66.05 -39.81 90.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.2 -0.938 . . . . 0.0 110.244 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.529 HG11 ' CG1' ' A' ' 123' ' ' VAL . 9.6 t -55.49 -57.12 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.178 -0.951 . . . . 0.0 110.175 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.625 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 17.3 t80 -48.77 -66.77 0.34 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -0.924 . . . . 0.0 110.019 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.451 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.3 OUTLIER -49.22 -25.29 2.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.366 -0.834 . . . . 0.0 109.963 179.851 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.561 ' HB2' HD23 ' A' ' 64' ' ' LEU . . . -67.75 -50.71 55.82 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.278 -0.889 . . . . 0.0 110.172 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.549 ' HE3' HG12 ' A' ' 123' ' ' VAL . 3.2 mpp? -54.91 -29.79 56.83 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.358 -0.839 . . . . 0.0 110.198 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.4 ' CG2' ' HE3' ' A' ' 40' ' ' MET . 2.6 m -67.59 -53.88 24.47 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.355 -0.841 . . . . 0.0 110.527 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.54 ' HG ' ' CD1' ' A' ' 84' ' ' LEU . 21.0 tp -55.84 -53.33 58.04 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.224 -0.922 . . . . 0.0 110.106 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.56 ' HE2' ' CH2' ' A' ' 61' ' ' TRP . 0.4 OUTLIER -55.0 -24.99 26.95 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.095 -1.003 . . . . 0.0 110.446 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.526 ' CA ' HD12 ' A' ' 130' ' ' LEU . 2.8 tt0 -79.37 -59.44 2.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.066 -1.021 . . . . 0.0 110.436 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.584 ' CE1' ' CG2' ' A' ' 87' ' ' THR . 17.8 t80 -53.45 -31.35 45.11 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.423 -0.798 . . . . 0.0 111.013 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.563 HD23 ' HB1' ' A' ' 44' ' ' ALA . 73.9 mt -77.87 -29.98 50.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 0.0 110.638 -179.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.545 ' N ' HG11 ' A' ' 92' ' ' VAL . 26.5 mt -64.09 -11.59 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.087 -1.008 . . . . 0.0 109.974 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -107.43 -72.35 0.72 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.27 -0.894 . . . . 0.0 110.168 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.584 ' CG2' ' CE1' ' A' ' 83' ' ' TYR . 12.2 t -89.16 1.3 55.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.15 -0.969 . . . . 0.0 110.189 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.547 ' O ' ' CB ' ' A' ' 89' ' ' SER . . . -91.35 28.1 8.62 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.5 OUTLIER 75.06 149.29 0.1 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.562 -0.964 . . . . 0.0 110.114 -179.822 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.74 -10.3 12.33 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.391 -0.818 . . . . 0.0 110.635 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 73.8 mtp85 -70.32 -45.82 65.46 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.059 -1.026 . . . . 0.0 109.647 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.545 HG11 ' N ' ' A' ' 85' ' ' ILE . 96.9 t -52.56 -30.94 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 O-C-N 121.488 -0.758 . . . . 0.0 110.039 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.463 ' HA ' HG12 ' A' ' 85' ' ' ILE . 21.0 t -81.23 -37.39 28.66 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.323 -0.861 . . . . 0.0 109.884 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.407 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 24.4 mm-40 -56.61 -52.55 64.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -0.873 . . . . 0.0 109.927 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.437 ' HB3' ' SD ' ' A' ' 57' ' ' MET . 7.0 tp60 -57.26 -36.95 71.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.465 -0.772 . . . . 0.0 109.594 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.6 t -57.22 -39.64 75.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.272 -0.892 . . . . 0.0 109.651 179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -71.79 -30.3 65.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.497 -0.752 . . . . 0.0 109.66 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 61.9 mt-10 -83.94 -11.83 56.27 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.453 -0.779 . . . . 0.0 110.029 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -128.41 32.08 4.91 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.375 -0.828 . . . . 0.0 110.133 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.401 ' O ' ' HB2' ' A' ' 104' ' ' GLN . 1.4 ppp? -63.9 -20.44 65.85 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.263 -0.898 . . . . 0.0 110.118 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.474 ' O ' ' HB ' ' A' ' 105' ' ' THR . 31.6 m-85 -75.97 -20.85 57.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.277 -0.889 . . . . 0.0 110.274 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.539 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -85.72 -39.85 16.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.155 -0.966 . . . . 0.0 110.106 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.568 ' CG1' ' N ' ' A' ' 104' ' ' GLN . 3.6 p -73.93 -41.91 53.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.637 0 CA-C-O 122.033 0.92 . . . . 0.0 109.141 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.568 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 3.7 mm-40 -69.42 -24.51 63.85 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.68 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.539 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 5.0 t -59.53 -27.77 66.48 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.953 -1.092 . . . . 0.0 109.932 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.579 ' CD1' ' CD2' ' A' ' 64' ' ' LEU . 61.8 mt -59.44 -37.74 78.89 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.324 -0.86 . . . . 0.0 110.144 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.422 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 34.8 ttpt . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.021 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.54 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.0 p . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 121.341 0.591 . . . . 0.0 110.149 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.54 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 15.3 m-20 -36.36 -29.1 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.877 -0.514 . . . . 0.0 111.022 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.549 HG12 ' HE3' ' A' ' 78' ' ' MET . 12.0 t -73.72 -64.72 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.122 -0.986 . . . . 0.0 110.358 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.422 ' HG3' ' HA ' ' A' ' 107' ' ' LYS . 35.5 ttp180 -51.96 -31.25 28.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.256 -0.902 . . . . 0.0 110.77 -179.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -76.31 -46.98 25.25 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.173 -0.955 . . . . 0.0 110.617 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.625 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -55.43 -49.71 71.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.99 . . . . 0.0 110.257 -179.763 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.539 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -66.33 -41.31 89.78 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.305 -0.872 . . . . 0.0 110.712 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -34.25 73.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.178 -0.951 . . . . 0.0 110.762 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -77.67 -28.54 51.17 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.183 -0.948 . . . . 0.0 110.861 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.529 HD23 ' CD1' ' A' ' 85' ' ' ILE . 5.1 tt -68.74 -48.0 64.89 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.134 -0.979 . . . . 0.0 110.282 -179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.483 HG23 ' CG1' ' A' ' 103' ' ' VAL . 5.3 t -69.4 -28.18 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.261 -0.899 . . . . 0.0 110.137 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.48 -47.12 57.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.852 . . . . 0.0 110.432 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.98 -33.56 70.82 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.18 -0.95 . . . . 0.0 110.4 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.542 ' CD1' HG23 ' A' ' 85' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.168 -0.958 . . . . 0.0 110.425 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.421 ' O ' ' HB ' ' A' ' 22' ' ' ILE . 50.7 mt-10 . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.23 0.538 . . . . 0.0 110.491 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.493 ' HB3' HD23 ' A' ' 46' ' ' LEU . . . -56.86 -54.59 44.71 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.156 -0.965 . . . . 0.0 110.129 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' A' ' 20' ' ' ALA . 5.7 pt-20 -43.75 -26.49 0.25 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.095 -1.003 . . . . 0.0 109.975 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.421 ' HB ' ' O ' ' A' ' 19' ' ' GLU . 21.5 mm -77.72 -49.01 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.293 -0.879 . . . . 0.0 110.074 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.67 -42.94 75.83 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.296 -0.878 . . . . 0.0 110.138 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.506 HG11 ' CD2' ' A' ' 80' ' ' LEU . 78.4 t -65.43 -41.96 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.249 -0.907 . . . . 0.0 110.048 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -50.42 -44.86 55.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.197 -0.939 . . . . 0.0 110.159 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -79.04 -26.98 43.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.382 -0.824 . . . . 0.0 110.188 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' CD2' ' A' ' 39' ' ' LEU . . . -64.42 -23.06 67.16 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.166 -0.959 . . . . 0.0 110.197 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.4 p . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 110.178 179.979 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.502 ' CD2' ' HB1' ' A' ' 27' ' ' ALA . 1.1 tp . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.304 0.573 . . . . 0.0 110.122 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.462 ' HE3' HG22 ' A' ' 79' ' ' THR . 3.9 mtm -70.11 -43.42 71.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.193 -0.942 . . . . 0.0 110.152 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.467 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 0.1 OUTLIER -60.6 -35.56 76.42 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.286 -0.884 . . . . 0.0 110.129 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -73.51 -39.55 64.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.274 -0.891 . . . . 0.0 110.121 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.523 ' CG2' HD11 ' A' ' 80' ' ' LEU . 67.8 mt -64.79 -33.15 61.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 0.0 109.968 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.51 ' HB3' HD21 ' A' ' 84' ' ' LEU . . . -74.58 -48.64 25.51 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.213 -0.929 . . . . 0.0 108.956 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.7 -23.03 5.89 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.493 HD23 ' HB3' ' A' ' 20' ' ' ALA . 9.9 mt -77.3 -39.57 47.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.831 -0.543 . . . . 0.0 109.942 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.546 HG23 HG23 ' A' ' 92' ' ' VAL . 81.0 p -48.79 -42.85 37.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.103 -0.998 . . . . 0.0 109.037 179.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.579 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 75.3 m-85 -45.05 -47.66 11.79 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.196 -0.94 . . . . 0.0 109.199 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.533 ' O ' ' C ' ' A' ' 50' ' ' VAL . 2.3 m-80 -66.88 89.83 0.17 Allowed 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.46 0.648 . . . . 0.0 110.421 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.533 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.19 -59.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.681 178.331 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.556 HG13 ' N ' ' A' ' 52' ' ' ALA . 2.7 t -64.57 -65.09 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.157 -0.964 . . . . 0.0 110.424 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.556 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -36.52 -43.63 0.4 Allowed 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.149 0.5 . . . . 0.0 111.173 -177.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.589 ' CE1' ' HA ' ' A' ' 92' ' ' VAL . 6.5 t80 -58.99 -58.11 10.1 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.242 -0.911 . . . . 0.0 110.454 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.8 t -51.42 -36.0 41.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.258 -0.901 . . . . 0.0 110.46 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.9 -28.9 60.82 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.304 -0.873 . . . . 0.0 110.402 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.492 HG22 ' CG2' ' A' ' 24' ' ' VAL . 22.2 mt -73.03 -70.01 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -0.89 . . . . 0.0 110.472 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.535 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 65.2 mmm -46.14 -36.35 5.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.096 -1.003 . . . . 0.0 110.021 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.5 m -53.83 -63.84 1.02 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.325 -0.86 . . . . 0.0 110.197 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.438 ' HE1' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -56.9 -31.44 64.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.066 -1.021 . . . . 0.0 109.478 179.696 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.535 HD12 ' CD2' ' A' ' 80' ' ' LEU . 0.8 OUTLIER -63.15 -34.12 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.467 -0.771 . . . . 0.0 109.852 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 57' ' ' MET . 34.6 m95 -78.15 -29.33 48.65 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.186 -0.946 . . . . 0.0 110.186 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -58.74 7.09 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.243 -0.911 . . . . 0.0 110.197 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.462 ' HB3' ' HB3' ' A' ' 73' ' ' HIS . 2.8 mtt180 -71.04 -15.62 62.56 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.279 -0.888 . . . . 0.0 110.127 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.618 HD21 HD13 ' A' ' 106' ' ' LEU . 13.5 mt -80.73 -8.33 59.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.354 -0.841 . . . . 0.0 110.581 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.238 -0.914 . . . . 0.0 111.223 -179.321 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.546 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 44.0 p-90 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.245 0.545 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.546 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 38.7 mtt180 -49.24 -48.04 46.02 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.217 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.462 ' HB3' ' HB3' ' A' ' 63' ' ' ARG . 30.1 m170 -54.19 -47.75 71.72 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.267 -0.896 . . . . 0.0 110.176 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.594 ' CG1' ' CG2' ' A' ' 123' ' ' VAL . 47.1 t -47.96 -50.4 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.257 -0.902 . . . . 0.0 110.206 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -52.6 -61.36 2.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.225 -0.922 . . . . 0.0 109.94 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.457 ' HE2' ' O ' ' A' ' 72' ' ' ARG . 8.5 mtmm -52.32 -23.17 5.4 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.239 -0.913 . . . . 0.0 109.476 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.563 ' HB1' ' CD2' ' A' ' 64' ' ' LEU . . . -70.91 -46.54 62.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.344 -0.848 . . . . 0.0 109.909 179.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.523 ' CE ' HG21 ' A' ' 123' ' ' VAL . 0.1 OUTLIER -53.19 -37.62 62.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.451 -0.781 . . . . 0.0 109.967 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.473 ' O ' ' HB3' ' A' ' 82' ' ' GLU . 1.9 m -62.86 -63.09 1.31 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.191 -0.943 . . . . 0.0 110.15 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.535 ' CD2' HD12 ' A' ' 60' ' ' ILE . 15.3 tp -44.86 -69.55 0.13 Allowed 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.199 -0.938 . . . . 0.0 109.39 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.468 ' O ' HG13 ' A' ' 85' ' ' ILE . 6.5 ttp -39.09 -35.96 0.27 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.495 -0.753 . . . . 0.0 110.811 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.473 ' HB3' ' O ' ' A' ' 79' ' ' THR . 1.6 tm-20 -69.54 -66.16 0.62 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.011 -1.056 . . . . 0.0 110.247 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.497 ' CE1' HG21 ' A' ' 87' ' ' THR . 24.1 t80 -41.76 -48.81 4.32 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.237 -0.914 . . . . 0.0 110.841 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 7.5 mt -59.85 -48.48 81.52 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.084 -1.01 . . . . 0.0 110.278 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.479 ' CA ' HG12 ' A' ' 92' ' ' VAL . 76.0 mt -55.08 -23.37 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.189 -0.945 . . . . 0.0 110.008 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -87.73 -77.44 0.35 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.24 -0.912 . . . . 0.0 110.146 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.497 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.9 t -89.64 -20.56 23.54 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 110.258 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.579 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -43.74 -73.93 0.23 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.3 OUTLIER 172.32 175.09 0.09 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.194 -1.18 . . . . 0.0 110.223 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -73.65 -16.81 61.21 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.235 -0.916 . . . . 0.0 110.168 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -76.57 -35.09 58.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.252 -0.905 . . . . 0.0 110.05 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.589 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 69.9 t -63.06 -51.92 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.211 -0.931 . . . . 0.0 110.053 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 p -61.37 -43.2 99.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.199 -0.938 . . . . 0.0 109.993 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 6.4 mm-40 -53.18 -49.45 66.67 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.229 -0.919 . . . . 0.0 109.815 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.466 ' OE1' ' CB ' ' A' ' 57' ' ' MET . 5.2 tt0 -55.35 -44.01 75.57 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.489 -0.757 . . . . 0.0 109.62 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -43.21 62.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.336 -0.853 . . . . 0.0 109.432 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -66.73 -35.36 79.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.752 . . . . 0.0 109.829 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 19.7 mt-10 -78.62 -11.06 59.95 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.362 -0.836 . . . . 0.0 109.887 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -136.21 38.45 2.73 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.356 -0.84 . . . . 0.0 110.068 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 3.5 mtp -62.76 -33.29 74.85 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.286 -0.884 . . . . 0.0 110.221 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.451 ' O ' ' HB ' ' A' ' 105' ' ' THR . 4.2 m-30 -59.99 -21.12 60.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.322 -0.861 . . . . 0.0 110.039 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.453 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -81.87 -42.68 19.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.347 -0.845 . . . . 0.0 110.139 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.518 HG11 ' CG2' ' A' ' 131' ' ' VAL . 2.5 t -75.22 -19.59 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.38 -0.825 . . . . 0.0 109.927 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -91.89 -32.17 15.4 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.291 -0.881 . . . . 0.0 110.115 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.478 HG22 ' N ' ' A' ' 106' ' ' LEU . 14.7 t -58.15 -23.82 56.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.314 -0.866 . . . . 0.0 109.873 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.618 HD13 HD21 ' A' ' 64' ' ' LEU . 11.4 mt -69.19 -41.07 77.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.319 -0.863 . . . . 0.0 110.041 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.4 ' O ' ' HD2' ' A' ' 124' ' ' ARG . 6.2 ttpp . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.337 -0.852 . . . . 0.0 110.258 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.558 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.5 p . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 121.4 0.619 . . . . 0.0 109.93 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.558 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.5 OUTLIER -45.18 -49.8 11.85 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.421 -0.799 . . . . 0.0 110.104 179.868 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.594 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 7.1 p -59.49 -37.51 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 0.0 110.384 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 121' ' ' VAL . 14.8 mtm180 -62.75 -68.11 0.36 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.21 -0.931 . . . . 0.0 110.789 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.474 ' HG3' ' O ' ' A' ' 122' ' ' ASN . 0.0 OUTLIER -52.51 -33.26 44.26 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.311 -0.868 . . . . 0.0 110.96 -179.321 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 0.7 OUTLIER -59.56 -55.23 37.18 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.938 -1.101 . . . . 0.0 110.175 -179.937 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.408 ' HB3' ' HE2' ' A' ' 78' ' ' MET . . . -53.89 -41.32 67.46 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.235 -0.915 . . . . 0.0 110.44 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.75 -35.66 75.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.247 -0.908 . . . . 0.0 110.421 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -66.72 -50.9 61.29 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.246 -0.909 . . . . 0.0 110.43 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.524 ' O ' ' CD1' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -54.11 -29.63 45.6 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.209 -0.932 . . . . 0.0 110.156 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.518 ' CG2' HG11 ' A' ' 103' ' ' VAL . 85.6 t -83.33 -29.6 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.307 -0.871 . . . . 0.0 110.224 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.4 -50.9 41.65 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.354 -0.842 . . . . 0.0 110.402 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.31 -51.44 66.0 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.211 -0.93 . . . . 0.0 110.382 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.524 ' CD1' ' O ' ' A' ' 130' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.178 -0.951 . . . . 0.0 110.301 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.228 0.537 . . . . 0.0 110.502 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.492 ' CB ' HD23 ' A' ' 46' ' ' LEU . . . -66.71 -48.59 68.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.096 -1.002 . . . . 0.0 110.236 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.423 ' C ' ' O ' ' A' ' 20' ' ' ALA . 24.4 pt-20 -43.55 -34.71 1.46 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.105 -0.997 . . . . 0.0 110.153 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.403 HG13 ' HG3' ' A' ' 21' ' ' GLU . 67.4 mt -74.53 -41.19 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.27 -0.894 . . . . 0.0 110.108 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -59.79 -46.5 88.99 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.225 -0.922 . . . . 0.0 110.193 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.532 ' CG2' HG21 ' A' ' 56' ' ' ILE . 16.8 t -60.27 -35.92 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.232 -0.917 . . . . 0.0 110.1 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -35.69 80.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.232 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -77.17 -34.8 56.33 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.238 -0.914 . . . . 0.0 110.085 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.511 ' N ' HD22 ' A' ' 39' ' ' LEU . . . -63.66 -24.13 67.66 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.29 -0.881 . . . . 0.0 110.119 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.483 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 56.2 p . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.222 -0.923 . . . . 0.0 110.088 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.511 HD22 ' N ' ' A' ' 27' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.14 0.495 . . . . 0.0 110.255 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 16.6 mtt -62.23 -62.16 1.96 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.271 -0.893 . . . . 0.0 110.242 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.45 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 50.0 m -53.97 -18.53 3.59 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.317 -0.865 . . . . 0.0 110.322 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -57.75 3.59 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 0.0 110.423 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.516 ' CG2' HD13 ' A' ' 80' ' ' LEU . 4.1 mt -48.34 -30.68 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.144 -0.973 . . . . 0.0 110.143 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.561 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -71.28 -56.04 6.82 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.095 -1.003 . . . . 0.0 109.558 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.426 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 12.1 t0 -49.98 -24.37 2.55 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.944 -1.098 . . . . 0.0 108.83 179.096 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.531 ' O ' ' CB ' ' A' ' 52' ' ' ALA . 2.5 mt -74.04 -43.01 59.4 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.623 -0.673 . . . . 0.0 109.965 179.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.535 HG23 HG21 ' A' ' 92' ' ' VAL . 70.7 p -48.49 -42.97 34.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.163 -0.961 . . . . 0.0 109.324 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.568 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 79.8 m-85 -46.2 -47.48 17.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.261 -0.9 . . . . 0.0 109.237 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.549 ' O ' ' C ' ' A' ' 50' ' ' VAL . 1.1 t30 -68.74 91.34 0.44 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.549 -0.72 . . . . 0.0 110.434 179.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.549 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.65 -59.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.159 177.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.547 HG13 ' N ' ' A' ' 52' ' ' ALA . 2.6 t -62.65 -64.39 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.033 -1.042 . . . . 0.0 110.076 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.547 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -36.18 -48.09 0.6 Allowed 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.891 -177.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.504 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 13.9 t80 -57.67 -54.17 49.87 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.278 -0.889 . . . . 0.0 110.069 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.442 ' O ' ' OG ' ' A' ' 58' ' ' SER . 12.8 t -54.5 -24.6 21.2 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.298 -0.876 . . . . 0.0 110.042 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 51' ' ' VAL . 14.4 mm-40 -86.14 -28.02 24.24 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.283 -0.886 . . . . 0.0 109.973 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.532 HG21 ' CG2' ' A' ' 24' ' ' VAL . 6.4 mt -80.67 -70.31 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.345 -0.847 . . . . 0.0 110.147 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.439 ' HG2' ' HG2' ' A' ' 95' ' ' GLN . 0.9 OUTLIER -46.22 -39.42 9.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.322 -0.861 . . . . 0.0 110.031 179.766 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 54' ' ' SER . 4.4 m -56.44 -58.83 6.34 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.288 -0.882 . . . . 0.0 110.062 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 18.9 mmt -63.01 -15.93 58.08 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.253 -0.905 . . . . 0.0 109.968 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.56 HG21 HD11 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -81.31 -31.4 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 109.653 179.751 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.561 ' CZ3' ' HB2' ' A' ' 102' ' ' ALA . 11.1 m95 -75.07 -46.13 36.84 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.287 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.449 ' O ' ' OD1' ' A' ' 65' ' ' ASN . 11.4 mtpt -59.56 -53.18 61.01 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.278 -0.889 . . . . 0.0 109.981 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 85.8 mmt-85 -65.81 -9.63 30.36 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -0.884 . . . . 0.0 109.954 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.649 HD21 HD11 ' A' ' 106' ' ' LEU . 7.0 mt -88.53 -20.63 24.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.35 -0.844 . . . . 0.0 110.44 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.505 ' O ' ' ND2' ' A' ' 65' ' ' ASN . 2.4 p-10 . . . . . 0 C--N 1.302 -1.473 0 O-C-N 121.202 -0.936 . . . . 0.0 110.351 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.415 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 65.6 p-90 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.193 0.52 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.36 -38.02 18.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.235 -0.916 . . . . 0.0 109.935 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.405 ' ND1' ' N ' ' A' ' 73' ' ' HIS . 2.5 m-70 -61.8 -41.33 97.61 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.353 -0.842 . . . . 0.0 109.861 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.545 ' CG1' HD22 ' A' ' 106' ' ' LEU . 28.7 t -58.08 -52.34 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.481 -0.762 . . . . 0.0 110.076 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.428 ' HB2' HG21 ' A' ' 123' ' ' VAL . 8.5 t80 -49.92 -53.18 27.68 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.335 -0.853 . . . . 0.0 110.15 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 4.9 mmtt -64.03 -25.55 68.17 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.246 -0.909 . . . . 0.0 110.107 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB1' ' CD2' ' A' ' 64' ' ' LEU . . . -73.38 -23.83 60.23 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.262 -0.899 . . . . 0.0 110.026 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.538 ' HE1' HG11 ' A' ' 74' ' ' VAL . 0.7 OUTLIER -77.12 -41.42 42.03 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.232 -0.917 . . . . 0.0 109.815 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.5 m -58.03 -55.7 31.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.463 -0.773 . . . . 0.0 110.062 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.541 ' CD2' HD12 ' A' ' 60' ' ' ILE . 31.8 tp -50.84 -57.63 7.98 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.367 -0.833 . . . . 0.0 109.784 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.513 ' HE2' ' CD1' ' A' ' 64' ' ' LEU . 1.8 ttp -47.29 -32.57 4.8 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.244 -0.91 . . . . 0.0 110.225 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.527 ' CA ' HD13 ' A' ' 130' ' ' LEU . 0.8 OUTLIER -75.17 -68.21 0.58 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.192 -0.943 . . . . 0.0 110.589 -179.908 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.456 ' O ' HG22 ' A' ' 87' ' ' THR . 48.7 t80 -40.33 -37.25 0.64 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 111.027 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.561 HD23 ' HB2' ' A' ' 44' ' ' ALA . 52.7 mt -76.09 -40.18 53.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.175 -0.953 . . . . 0.0 110.548 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.527 HG23 ' CD1' ' A' ' 134' ' ' LEU . 20.4 mt -53.47 -27.41 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 120.974 -1.079 . . . . 0.0 110.186 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.82 -74.78 0.49 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.121 -0.987 . . . . 0.0 110.422 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.469 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 11.2 t -86.06 -22.31 27.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.251 -0.905 . . . . 0.0 110.336 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.568 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -43.87 -74.06 0.22 Allowed Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.443 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 3.1 t 172.25 160.75 0.11 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.151 -1.205 . . . . 0.0 110.293 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.07 -19.5 32.26 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.27 -0.894 . . . . 0.0 110.087 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -76.52 -38.12 55.65 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.273 -0.892 . . . . 0.0 110.187 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.535 HG21 HG23 ' A' ' 47' ' ' THR . 71.6 t -60.01 -28.07 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.291 -0.881 . . . . 0.0 110.084 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.4 p -86.06 -38.54 17.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.234 -0.916 . . . . 0.0 110.162 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -58.84 -57.49 12.8 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.292 -0.88 . . . . 0.0 109.98 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.439 ' HG2' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -52.75 -35.74 56.72 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.4 -0.813 . . . . 0.0 109.875 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.495 ' O ' ' N ' ' A' ' 100' ' ' MET . 0.7 OUTLIER -59.55 -43.42 93.54 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.328 -0.858 . . . . 0.0 109.778 179.587 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -66.6 -35.93 81.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.322 179.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -80.84 -10.05 59.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.498 -0.752 . . . . 0.0 109.721 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -135.64 26.87 3.38 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.43 -0.794 . . . . 0.0 109.848 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.495 ' N ' ' O ' ' A' ' 96' ' ' CYS . 0.2 OUTLIER -61.53 -29.83 70.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.354 -0.841 . . . . 0.0 109.917 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -57.82 -27.31 63.03 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.329 -0.857 . . . . 0.0 109.816 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.561 ' HB2' ' CZ3' ' A' ' 61' ' ' TRP . . . -72.13 -41.52 67.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.41 -0.806 . . . . 0.0 110.043 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.475 HG13 ' CG2' ' A' ' 131' ' ' VAL . 3.3 t -76.9 -19.92 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.364 -0.835 . . . . 0.0 109.946 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.432 ' O ' ' HG3' ' A' ' 107' ' ' LYS . 1.1 mt-30 -91.28 -23.75 20.06 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.276 -0.89 . . . . 0.0 110.124 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.515 HG21 ' N ' ' A' ' 106' ' ' LEU . 7.7 t -75.85 -24.31 55.76 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.252 -0.905 . . . . 0.0 110.098 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.649 HD11 HD21 ' A' ' 64' ' ' LEU . 10.0 mt -61.05 -42.67 98.92 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.262 -0.899 . . . . 0.0 109.967 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.511 ' HA ' ' CA ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.198 -0.939 . . . . 0.0 110.014 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.511 ' O ' ' N ' ' A' ' 123' ' ' VAL . 6.6 t . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 121.054 0.454 . . . . 0.0 111.031 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.524 ' O ' ' CB ' ' A' ' 126' ' ' LYS . 16.2 m-80 -33.63 -33.54 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.766 -0.583 . . . . 0.0 111.197 -178.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.534 ' CG1' HG12 ' A' ' 74' ' ' VAL . 1.7 t -77.58 -49.2 22.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.916 -1.115 . . . . 0.0 109.703 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.511 ' CA ' ' HA ' ' A' ' 107' ' ' LYS . 10.9 mtm-85 -60.79 -56.6 19.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.109 -0.995 . . . . 0.0 110.732 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -62.1 -51.11 69.22 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.271 -0.893 . . . . 0.0 110.956 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 122' ' ' ASN . 0.6 OUTLIER -50.43 -48.32 56.31 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.012 -1.055 . . . . 0.0 110.255 -179.688 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.42 ' HB3' ' HE2' ' A' ' 78' ' ' MET . . . -55.19 -46.04 75.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.36 -0.838 . . . . 0.0 110.591 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -62.12 -35.48 78.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.115 -0.991 . . . . 0.0 110.414 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -60.36 -51.48 69.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -0.913 . . . . 0.0 110.555 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.527 HD13 ' CA ' ' A' ' 82' ' ' GLU . 2.1 tt -53.9 -36.76 63.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.14 -0.975 . . . . 0.0 110.295 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.475 ' CG2' HG13 ' A' ' 103' ' ' VAL . 76.5 t -74.87 -27.1 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.353 -0.842 . . . . 0.0 110.144 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.42 -51.5 43.16 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.374 -0.829 . . . . 0.0 110.576 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.456 HD11 HD11 ' A' ' 134' ' ' LEU . 2.2 pp -63.83 -26.04 68.44 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.202 -0.936 . . . . 0.0 110.384 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.527 ' CD1' HG23 ' A' ' 85' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.666 0 O-C-N 121.268 -0.895 . . . . 0.0 110.106 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.227 0.537 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.492 ' CB ' HD12 ' A' ' 46' ' ' LEU . . . -67.85 -50.14 58.26 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.184 -0.947 . . . . 0.0 110.141 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.44 ' HG3' ' N ' ' A' ' 22' ' ' ILE . 16.7 pt-20 -49.21 -29.68 5.97 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.22 -0.925 . . . . 0.0 110.205 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.44 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 55.8 mt -74.71 -39.89 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.206 -0.934 . . . . 0.0 110.011 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.467 ' O ' HD11 ' A' ' 43' ' ' ILE . 14.7 mttp -70.66 -23.99 62.61 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.383 -0.823 . . . . 0.0 110.073 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.525 HG21 HG22 ' A' ' 56' ' ' ILE . 72.3 t -79.55 -34.1 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.249 -0.907 . . . . 0.0 110.152 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -40.38 87.73 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.296 -0.877 . . . . 0.0 110.263 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -44.12 54.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.335 -0.853 . . . . 0.0 110.176 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.518 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -57.06 -20.55 25.59 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.242 -0.911 . . . . 0.0 110.114 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.523 ' O ' ' CB ' ' A' ' 76' ' ' LYS . 2.5 p . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.214 -0.929 . . . . 0.0 110.077 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.518 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 13.1 tp . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.266 0.555 . . . . 0.0 110.333 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.402 ' HE3' HG23 ' A' ' 79' ' ' THR . 0.0 OUTLIER -63.09 -42.61 99.65 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.15 -0.969 . . . . 0.0 110.316 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.466 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.3 OUTLIER -61.53 -33.46 73.86 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.118 -0.989 . . . . 0.0 110.193 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.08 -44.23 60.79 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.195 -0.94 . . . . 0.0 110.0 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.507 ' CG2' HD12 ' A' ' 80' ' ' LEU . 85.4 mt -59.64 -31.34 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.192 -0.942 . . . . 0.0 110.021 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.539 ' CA ' ' CD2' ' A' ' 84' ' ' LEU . . . -72.58 -52.79 14.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.924 . . . . 0.0 109.522 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.435 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 27.9 t0 -51.52 -22.39 3.14 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.988 -1.07 . . . . 0.0 108.679 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.492 HD12 ' CB ' ' A' ' 20' ' ' ALA . 15.1 mt -77.68 -40.64 40.8 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.593 -0.692 . . . . 0.0 109.908 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.533 HG22 HG21 ' A' ' 92' ' ' VAL . 68.0 p -49.64 -42.95 46.4 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.154 -0.967 . . . . 0.0 109.407 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.545 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 85.3 m-85 -44.88 -45.37 10.25 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.241 -0.912 . . . . 0.0 109.486 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.534 ' O ' ' N ' ' A' ' 51' ' ' VAL . 3.4 t-20 -71.47 92.65 1.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.511 -0.743 . . . . 0.0 110.331 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.523 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.75 -56.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.863 178.301 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.549 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.8 t -64.21 -65.7 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 120.954 -1.091 . . . . 0.0 110.495 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.549 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -37.51 -45.01 0.7 Allowed 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 121.169 0.509 . . . . 0.0 110.972 -177.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.575 ' CE1' HG23 ' A' ' 92' ' ' VAL . 16.7 t80 -60.19 -53.82 53.14 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.32 -0.862 . . . . 0.0 110.425 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 58' ' ' SER . 9.2 t -56.62 -21.07 24.46 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.221 -0.924 . . . . 0.0 110.152 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -93.75 -22.46 18.69 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -0.894 . . . . 0.0 110.368 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.525 HG22 HG21 ' A' ' 24' ' ' VAL . 30.1 mt -81.67 -55.95 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.242 -0.911 . . . . 0.0 110.203 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.558 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 90.8 mmm -58.6 -36.12 73.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.196 -0.94 . . . . 0.0 109.705 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 54' ' ' SER . 0.3 OUTLIER -59.02 -55.3 36.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.332 -0.855 . . . . 0.0 109.801 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.439 ' CB ' HG13 ' A' ' 24' ' ' VAL . 3.0 mmt -63.29 -25.08 68.15 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.225 -0.922 . . . . 0.0 109.766 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.571 HG21 HD13 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -73.67 -31.0 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.519 -0.738 . . . . 0.0 109.824 179.817 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.494 ' CE3' HD12 ' A' ' 64' ' ' LEU . 16.4 m95 -76.39 -56.99 4.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.127 -0.983 . . . . 0.0 110.143 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.13 -50.84 10.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.247 -0.908 . . . . 0.0 110.214 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -68.38 -31.87 71.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.212 -0.93 . . . . 0.0 110.151 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.699 HD22 HD12 ' A' ' 106' ' ' LEU . 7.4 mt -65.25 -26.82 68.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.29 -0.882 . . . . 0.0 110.054 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.302 -1.457 0 O-C-N 121.338 -0.851 . . . . 0.0 109.933 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.402 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 51.2 p-90 . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.269 0.557 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.54 -37.74 58.29 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.264 -0.897 . . . . 0.0 110.215 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.452 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 1.5 m-70 -68.04 -32.03 72.11 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.303 -0.873 . . . . 0.0 110.204 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.598 ' CG1' ' CG2' ' A' ' 123' ' ' VAL . 27.1 t -64.71 -59.4 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.196 -0.94 . . . . 0.0 110.2 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -47.02 -53.42 12.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.266 -0.896 . . . . 0.0 109.936 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -59.27 -33.07 70.61 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.239 -0.913 . . . . 0.0 109.63 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.532 ' HB2' HD21 ' A' ' 64' ' ' LEU . . . -66.71 -28.85 68.76 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.287 -0.883 . . . . 0.0 109.645 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.5 ' HE1' HG12 ' A' ' 74' ' ' VAL . 1.8 mtt -71.0 -32.92 69.86 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.282 -0.886 . . . . 0.0 109.923 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.402 HG23 ' HE3' ' A' ' 40' ' ' MET . 8.0 m -67.87 -37.1 81.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.326 -0.859 . . . . 0.0 110.307 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.527 ' CD1' HD11 ' A' ' 84' ' ' LEU . 23.1 tp -73.06 -37.85 66.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.213 -0.929 . . . . 0.0 110.022 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.533 ' HG2' ' CD2' ' A' ' 130' ' ' LEU . 3.2 ttt -73.61 -27.0 61.06 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.173 -0.955 . . . . 0.0 109.946 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.538 ' CA ' HD12 ' A' ' 130' ' ' LEU . 1.8 tt0 -80.05 -37.67 33.5 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 110.015 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.466 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 37.1 t80 -72.7 -46.06 55.64 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.386 -0.821 . . . . 0.0 110.349 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.539 ' CD2' ' CA ' ' A' ' 44' ' ' ALA . 76.3 mt -66.63 -43.54 84.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.266 -0.896 . . . . 0.0 110.34 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.547 ' CD1' HD21 ' A' ' 130' ' ' LEU . 8.6 mt -53.41 -19.32 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.107 -0.996 . . . . 0.0 109.681 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -96.22 -79.32 0.45 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.272 -0.893 . . . . 0.0 110.18 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.463 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 10.2 t -80.08 -23.63 41.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.221 -0.924 . . . . 0.0 110.288 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.545 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -43.97 -71.11 0.48 Allowed Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.466 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.6 OUTLIER 171.78 160.59 0.1 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.203 -1.175 . . . . 0.0 110.174 179.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -59.61 -16.17 23.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.219 -0.925 . . . . 0.0 110.093 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.0 mmt180 -79.79 -40.97 27.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.281 -0.887 . . . . 0.0 110.323 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.575 HG23 ' CE1' ' A' ' 53' ' ' PHE . 53.1 t -57.91 -38.17 64.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.151 -0.968 . . . . 0.0 109.933 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.2 m -71.49 -42.69 67.73 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.177 -0.952 . . . . 0.0 109.779 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -56.13 -39.73 72.7 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.287 -0.883 . . . . 0.0 109.777 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.488 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 3.9 tt0 -68.64 -38.02 80.17 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.376 -0.827 . . . . 0.0 109.296 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.443 ' SG ' HD21 ' A' ' 134' ' ' LEU . 51.8 t -58.1 -28.62 64.78 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.028 -1.045 . . . . 0.0 108.807 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -87.2 -20.99 26.15 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.519 -0.738 . . . . 0.0 110.04 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.1 pt-20 -84.52 -20.01 32.3 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.104 -0.998 . . . . 0.0 109.932 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -124.7 44.49 2.76 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.394 -0.816 . . . . 0.0 110.099 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.12 -34.73 76.9 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.247 -0.908 . . . . 0.0 110.106 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -59.94 -21.44 61.17 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.362 -0.836 . . . . 0.0 110.01 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.47 ' HA ' HG22 ' A' ' 105' ' ' THR . . . -82.46 -42.39 18.57 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.327 -0.858 . . . . 0.0 110.292 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.468 HG22 ' CZ3' ' A' ' 61' ' ' TRP . 2.6 t -75.06 -18.82 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.325 -0.859 . . . . 0.0 110.268 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.455 ' HG2' HG21 ' A' ' 131' ' ' VAL . 6.8 mm-40 -95.33 -27.77 15.3 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.212 -0.93 . . . . 0.0 110.649 -179.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.47 HG22 ' HA ' ' A' ' 102' ' ' ALA . 9.7 t -64.95 -14.67 60.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.089 -1.007 . . . . 0.0 110.094 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.699 HD12 HD22 ' A' ' 64' ' ' LEU . 8.9 mt -65.26 -34.23 77.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.356 -0.84 . . . . 0.0 110.197 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.343 -0.848 . . . . 0.0 110.428 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.546 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.443 0.64 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.546 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.6 OUTLIER -49.08 -50.96 34.32 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.488 -0.758 . . . . 0.0 110.007 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.598 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 6.4 p -74.24 -20.61 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.072 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.448 ' HB3' ' O ' ' A' ' 121' ' ' VAL . 9.9 ttt180 -68.29 -65.29 0.72 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.153 -0.967 . . . . 0.0 110.392 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -62.07 -28.92 69.95 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.382 -0.824 . . . . 0.0 110.47 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -58.55 7.95 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.063 -1.023 . . . . 0.0 110.082 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -51.87 -40.27 60.35 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.202 -0.936 . . . . 0.0 110.0 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -63.36 -36.85 85.09 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.282 -0.886 . . . . 0.0 110.375 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.49 -49.81 73.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.253 -0.904 . . . . 0.0 110.404 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.547 HD21 ' CD1' ' A' ' 85' ' ' ILE . 0.9 OUTLIER -56.98 -28.84 62.73 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.963 -1.086 . . . . 0.0 109.654 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.458 HG22 HG11 ' A' ' 103' ' ' VAL . 55.7 t -78.53 -27.78 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.282 -0.886 . . . . 0.0 109.728 179.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -75.61 -57.41 3.9 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.378 -0.826 . . . . 0.0 110.374 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.95 -34.85 4.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.218 -0.926 . . . . 0.0 110.446 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.484 ' CD1' ' O ' ' A' ' 130' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 O-C-N 121.134 -0.979 . . . . 0.0 110.394 -179.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.16 0.505 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.458 ' HA ' HD11 ' A' ' 46' ' ' LEU . . . -58.42 -50.34 74.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.152 -0.968 . . . . 0.0 110.133 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' A' ' 20' ' ' ALA . 8.0 pt-20 -43.23 -29.64 0.41 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.27 -0.893 . . . . 0.0 110.08 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.7 mt -82.59 -43.13 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.238 -0.914 . . . . 0.0 110.073 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.49 ' O ' ' CD1' ' A' ' 39' ' ' LEU . 8.0 mmtm -57.11 -32.34 66.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.311 -0.868 . . . . 0.0 110.111 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.563 HG21 HG21 ' A' ' 56' ' ' ILE . 87.0 t -76.34 -43.6 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.986 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.18 -39.22 74.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.316 -0.865 . . . . 0.0 110.126 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -83.18 -29.48 28.53 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.393 -0.817 . . . . 0.0 110.154 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.515 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . . . -62.14 -25.05 67.52 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.299 -0.876 . . . . 0.0 110.014 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.484 ' CA ' ' HB3' ' A' ' 76' ' ' LYS . 28.3 p . . . . . 0 N--CA 1.489 1.508 0 O-C-N 121.259 -0.901 . . . . 0.0 110.111 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.515 ' CD1' ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.206 0.527 . . . . 0.0 110.318 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.412 ' HE3' HG21 ' A' ' 79' ' ' THR . 8.2 mmm -75.84 -60.67 2.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.235 -0.916 . . . . 0.0 110.464 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 86.0 p -48.93 -29.33 4.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.167 -0.958 . . . . 0.0 110.366 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -74.36 -53.5 9.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.264 -0.897 . . . . 0.0 110.403 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.527 ' CG2' HD12 ' A' ' 80' ' ' LEU . 44.4 mt -53.52 -39.62 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -0.925 . . . . 0.0 110.112 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.513 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . . . -66.36 -51.08 60.78 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.076 -1.015 . . . . 0.0 109.168 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.449 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -56.22 -19.33 13.37 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.088 -1.008 . . . . 0.0 108.862 178.874 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.486 ' HB2' ' O ' ' A' ' 43' ' ' ILE . 13.5 mt -82.76 -38.53 23.08 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.572 -0.705 . . . . 0.0 110.092 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.513 ' HA ' ' CA ' ' A' ' 53' ' ' PHE . 61.7 p -51.75 -43.28 62.86 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.078 -1.014 . . . . 0.0 109.223 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.455 ' OH ' ' O ' ' A' ' 87' ' ' THR . 88.3 m-85 -43.18 -43.41 4.64 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.475 -0.765 . . . . 0.0 109.485 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.543 ' O ' ' N ' ' A' ' 51' ' ' VAL . 2.6 t-20 -73.17 93.44 1.84 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.558 -0.714 . . . . 0.0 110.328 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.519 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.95 -56.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.908 178.37 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.555 HG13 ' N ' ' A' ' 52' ' ' ALA . 3.1 t -66.19 -66.29 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.044 -1.035 . . . . 0.0 110.701 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.555 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -37.64 -46.09 0.84 Allowed 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.022 -177.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.559 ' CD1' HG21 ' A' ' 92' ' ' VAL . 3.1 t80 -56.44 -53.91 51.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.29 -0.881 . . . . 0.0 110.037 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.2 m -57.18 -21.83 36.09 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.144 -0.973 . . . . 0.0 110.025 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -88.95 -24.64 22.38 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.357 -0.839 . . . . 0.0 110.189 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.563 HG21 HG21 ' A' ' 24' ' ' VAL . 4.1 mt -79.15 -70.32 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.405 -0.809 . . . . 0.0 110.229 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.475 ' HE1' ' CZ2' ' A' ' 61' ' ' TRP . 5.0 mtp -46.17 -38.33 8.15 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.221 -0.925 . . . . 0.0 109.772 179.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -54.69 -62.08 1.89 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.358 -0.838 . . . . 0.0 110.048 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.455 ' HB3' HG12 ' A' ' 24' ' ' VAL . 0.0 OUTLIER -58.69 -23.11 58.86 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.969 179.786 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.571 HG23 HD12 ' A' ' 64' ' ' LEU . 0.3 OUTLIER -73.95 -31.75 31.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.295 -0.878 . . . . 0.0 109.834 179.718 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.547 ' CE3' HD11 ' A' ' 64' ' ' LEU . 14.0 m95 -76.29 -63.44 1.33 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.138 -0.976 . . . . 0.0 110.265 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -44.83 -45.43 10.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.297 -0.877 . . . . 0.0 110.405 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -69.69 -34.15 73.52 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.286 -0.884 . . . . 0.0 110.386 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.624 HD21 ' CD1' ' A' ' 106' ' ' LEU . 7.5 mt -57.51 -20.52 31.99 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.221 -0.925 . . . . 0.0 110.42 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.4 m120 . . . . . 0 C--N 1.303 -1.428 0 O-C-N 121.252 -0.905 . . . . 0.0 110.136 -179.712 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 47.7 p-90 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.237 0.541 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.76 -28.52 22.68 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.262 -0.899 . . . . 0.0 110.018 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.47 ' O ' ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -78.1 -35.12 49.65 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.269 -0.894 . . . . 0.0 110.021 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.588 ' CG1' ' CG2' ' A' ' 123' ' ' VAL . 13.3 t -60.65 -55.31 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.338 -0.851 . . . . 0.0 109.758 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -52.48 -52.85 52.26 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.35 -0.844 . . . . 0.0 109.874 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.484 ' HB3' ' CA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -61.13 -24.84 66.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.314 -0.866 . . . . 0.0 109.991 179.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.55 ' HB1' ' CD2' ' A' ' 64' ' ' LEU . . . -74.64 -34.02 62.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.309 -0.869 . . . . 0.0 109.997 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.554 ' HE3' HG12 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -66.87 -30.87 71.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.371 -0.831 . . . . 0.0 109.462 179.513 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.412 HG21 ' HE3' ' A' ' 40' ' ' MET . 3.2 m -66.73 -64.05 0.94 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.499 -0.75 . . . . 0.0 109.946 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.535 ' CD2' HD13 ' A' ' 60' ' ' ILE . 29.9 tp -46.87 -46.81 21.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.322 -0.861 . . . . 0.0 110.135 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.523 ' HE2' ' CZ2' ' A' ' 61' ' ' TRP . 19.6 ttm -56.53 -42.99 79.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.114 -0.991 . . . . 0.0 110.205 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.448 ' O ' ' C ' ' A' ' 83' ' ' TYR . 62.6 tt0 -68.49 -65.91 0.64 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.243 -0.91 . . . . 0.0 110.336 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.465 ' CE2' HG21 ' A' ' 87' ' ' THR . 57.9 t80 -37.52 -47.78 0.94 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.454 -0.779 . . . . 0.0 110.791 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.527 ' CB ' HG11 ' A' ' 92' ' ' VAL . 68.4 mt -68.03 -43.93 77.64 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.842 . . . . 0.0 110.222 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.561 ' N ' HG13 ' A' ' 92' ' ' VAL . 23.5 mt -47.9 -29.54 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.033 -1.042 . . . . 0.0 109.75 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.63 -72.6 0.61 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.326 -0.859 . . . . 0.0 110.111 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.465 HG21 ' CE2' ' A' ' 83' ' ' TYR . 8.0 t -83.8 -27.44 28.8 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.278 -0.889 . . . . 0.0 110.108 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.462 ' CA ' ' HA ' ' A' ' 84' ' ' LEU . . . -44.16 -85.83 0.01 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.465 ' O ' ' HB ' ' A' ' 92' ' ' VAL . 1.3 t -175.78 154.44 1.54 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -1.184 . . . . 0.0 110.382 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -47.68 -44.98 27.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.247 -0.908 . . . . 0.0 110.615 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -59.47 -43.43 93.24 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.42 -0.8 . . . . 0.0 110.199 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.561 HG13 ' N ' ' A' ' 85' ' ' ILE . 18.9 t -53.12 -25.55 9.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.483 0 O-C-N 121.318 -0.864 . . . . 0.0 109.85 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.0 t -91.2 -35.13 14.7 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 110.059 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -61.61 -53.01 61.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.294 -0.878 . . . . 0.0 110.018 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 11.2 tt0 -60.22 -38.52 83.63 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.332 -0.855 . . . . 0.0 109.254 179.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.44 ' SG ' HD12 ' A' ' 85' ' ' ILE . 0.1 OUTLIER -55.77 -30.19 60.88 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.104 -0.998 . . . . 0.0 109.016 179.144 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.53 -23.55 27.66 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.447 -0.783 . . . . 0.0 110.254 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 4.8 pt-20 -80.42 -21.5 42.14 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.189 -0.944 . . . . 0.0 109.635 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.54 41.13 2.9 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.494 -0.754 . . . . 0.0 109.836 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.445 ' HG3' ' N ' ' A' ' 101' ' ' TYR . 0.4 OUTLIER -61.04 -24.85 66.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.353 -0.842 . . . . 0.0 110.255 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.461 ' O ' ' HB ' ' A' ' 105' ' ' THR . 20.6 m-85 -68.67 -27.87 66.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.0 109.673 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.519 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -75.64 -43.62 46.85 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.439 -0.788 . . . . 0.0 110.062 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.485 HG12 HG21 ' A' ' 131' ' ' VAL . 2.9 t -71.36 -29.03 33.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.413 -0.804 . . . . 0.0 110.042 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.466 ' HG2' HG23 ' A' ' 131' ' ' VAL . 0.3 OUTLIER -83.56 -28.59 28.47 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.215 -0.928 . . . . 0.0 110.362 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.519 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 7.1 t -60.84 -23.51 65.16 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.193 -0.942 . . . . 0.0 110.108 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.624 ' CD1' HD21 ' A' ' 64' ' ' LEU . 19.0 mt -65.06 -41.95 94.66 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.233 -0.917 . . . . 0.0 109.936 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.449 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 31.2 ttpt . . . . . 0 N--CA 1.489 1.503 0 O-C-N 121.307 -0.871 . . . . 0.0 110.185 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.473 ' O ' ' C ' ' A' ' 122' ' ' ASN . 32.4 t . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.274 0.559 . . . . 0.0 111.422 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.498 ' O ' ' CB ' ' A' ' 126' ' ' LYS . 14.5 m120 -33.01 -55.62 0.39 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.733 -0.604 . . . . 0.0 111.414 -178.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.588 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 9.9 p -66.69 -39.7 84.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 120.852 -1.155 . . . . 0.0 109.904 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.468 ' N ' ' CG1' ' A' ' 123' ' ' VAL . 8.9 ttp180 -62.03 -70.9 0.17 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.167 -0.958 . . . . 0.0 110.634 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.403 ' N ' ' HG2' ' A' ' 124' ' ' ARG . 21.8 mt-10 -55.2 -28.67 54.68 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.241 -0.912 . . . . 0.0 110.656 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.498 ' CB ' ' O ' ' A' ' 122' ' ' ASN . 6.1 tptp -62.35 -62.4 1.78 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.092 -1.005 . . . . 0.0 109.578 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.419 ' HB3' ' SD ' ' A' ' 78' ' ' MET . . . -47.7 -40.87 21.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.356 -0.84 . . . . 0.0 110.004 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.26 -40.31 89.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.215 -0.928 . . . . 0.0 110.381 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -54.22 26.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.205 -0.934 . . . . 0.0 110.479 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.52 HD13 ' CD1' ' A' ' 85' ' ' ILE . 11.7 tp -46.95 -28.98 1.81 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.171 -0.956 . . . . 0.0 109.929 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.485 HG21 HG12 ' A' ' 103' ' ' VAL . 28.8 t -79.98 -38.77 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.347 -0.846 . . . . 0.0 109.784 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.81 -47.94 81.16 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.327 -0.858 . . . . 0.0 110.249 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 24.9 tp -54.38 -47.79 72.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.287 -0.883 . . . . 0.0 110.399 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.495 ' CD1' HD12 ' A' ' 85' ' ' ILE . 9.3 mt . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.162 -0.961 . . . . 0.0 110.237 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.26 0.552 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.494 ' HB2' ' CG1' ' A' ' 56' ' ' ILE . . . -53.31 -49.0 67.94 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.275 -0.891 . . . . 0.0 110.117 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.44 ' CG ' ' N ' ' A' ' 22' ' ' ILE . 14.4 pt-20 -44.06 -37.58 3.1 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.992 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.44 ' N ' ' CG ' ' A' ' 21' ' ' GLU . 29.3 mm -72.07 -42.63 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.322 -0.861 . . . . 0.0 110.074 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.501 ' O ' ' CD1' ' A' ' 39' ' ' LEU . 29.0 mmtt -56.41 -32.75 65.14 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.178 -0.951 . . . . 0.0 110.226 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.52 ' CG2' HG21 ' A' ' 56' ' ' ILE . 90.1 t -76.75 -37.46 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.294 -0.879 . . . . 0.0 110.191 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.3 -37.89 75.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.171 -0.956 . . . . 0.0 110.24 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -82.83 -48.85 10.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.328 -0.857 . . . . 0.0 110.164 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.519 ' HB3' ' CD1' ' A' ' 39' ' ' LEU . . . -44.6 -47.78 10.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.9 . . . . 0.0 110.17 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 76' ' ' LYS . 4.8 p . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.346 -0.846 . . . . 0.0 110.183 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.519 ' CD1' ' HB3' ' A' ' 27' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.271 0.558 . . . . 0.0 110.229 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -90.28 -59.38 2.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.281 -0.887 . . . . 0.0 110.203 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.07 -12.44 61.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.301 -0.874 . . . . 0.0 110.228 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -83.98 -66.01 0.94 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.292 -0.88 . . . . 0.0 110.336 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.519 ' CD1' HD13 ' A' ' 80' ' ' LEU . 79.8 mt -46.24 -38.1 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.217 -0.927 . . . . 0.0 110.094 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.561 ' HB1' HD22 ' A' ' 84' ' ' LEU . . . -68.11 -52.01 39.83 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.184 -0.948 . . . . 0.0 109.387 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.491 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 19.7 t0 -53.61 -20.84 5.68 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.064 -1.022 . . . . 0.0 108.912 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.486 ' CD1' ' HA ' ' A' ' 20' ' ' ALA . 13.4 mt -81.56 -36.41 29.11 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.578 -0.702 . . . . 0.0 110.06 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.526 HG23 HG21 ' A' ' 92' ' ' VAL . 73.1 p -52.19 -40.92 62.18 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.08 -1.013 . . . . 0.0 109.157 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.558 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 79.6 m-85 -43.22 -43.87 4.96 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 119.556 -0.857 . . . . 0.0 109.394 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 51' ' ' VAL . 1.2 t-20 -73.72 91.31 1.89 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.62 -0.675 . . . . 0.0 110.45 179.454 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -11.56 -56.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.696 178.183 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.547 HG13 ' N ' ' A' ' 52' ' ' ALA . 2.7 t -63.97 -65.85 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 120.972 -1.08 . . . . 0.0 110.197 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.547 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -39.33 -41.96 0.98 Allowed 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 121.241 0.543 . . . . 0.0 110.633 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.603 ' CE1' ' HA ' ' A' ' 92' ' ' VAL . 4.2 t80 -62.1 -57.57 11.09 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.458 -0.776 . . . . 0.0 110.546 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 58' ' ' SER . 0.4 OUTLIER -55.17 -24.7 28.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.21 -0.931 . . . . 0.0 110.418 -179.458 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -87.87 -25.0 23.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.247 -0.908 . . . . 0.0 110.272 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.52 HG21 ' CG2' ' A' ' 24' ' ' VAL . 19.7 mt -74.75 -70.28 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.369 -0.832 . . . . 0.0 110.426 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.467 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 4.2 mtp -45.82 -37.94 6.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.22 -0.925 . . . . 0.0 110.097 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.414 ' HB2' ' O ' ' A' ' 54' ' ' SER . 0.4 OUTLIER -53.22 -59.02 5.09 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.191 -0.943 . . . . 0.0 109.861 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -27.74 67.83 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.181 -0.949 . . . . 0.0 109.585 179.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.538 HG21 HD12 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -68.82 -29.05 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.425 -0.797 . . . . 0.0 109.705 179.539 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.508 ' CE3' HD11 ' A' ' 64' ' ' LEU . 20.9 m95 -79.08 -37.18 39.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.189 -0.944 . . . . 0.0 110.229 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -62.86 -56.76 14.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.255 -0.903 . . . . 0.0 110.314 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.43 -26.26 68.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.212 -0.93 . . . . 0.0 110.252 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.728 HD21 HD12 ' A' ' 106' ' ' LEU . 8.4 mt -64.51 -15.43 60.85 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.287 -0.883 . . . . 0.0 110.354 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.6 m120 . . . . . 0 C--N 1.302 -1.489 0 O-C-N 121.249 -0.907 . . . . 0.0 110.354 -179.394 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.507 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 26.0 p-90 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.293 0.568 . . . . 0.0 110.067 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.507 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 4.2 tpt180 -43.47 -43.4 5.35 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.27 -0.894 . . . . 0.0 110.097 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 39.3 m170 -56.86 -47.28 80.77 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.246 -0.909 . . . . 0.0 110.063 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.552 HG13 ' CG1' ' A' ' 123' ' ' VAL . 59.4 t -51.87 -49.57 36.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.287 -0.883 . . . . 0.0 109.925 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.523 ' CE1' ' HG2' ' A' ' 126' ' ' LYS . 10.0 t80 -51.41 -59.84 3.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.191 -0.943 . . . . 0.0 109.925 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.411 ' CB ' ' O ' ' A' ' 28' ' ' THR . 8.6 mmtt -52.1 -27.0 12.52 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.905 . . . . 0.0 109.779 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.524 ' HB3' ' CD2' ' A' ' 64' ' ' LEU . . . -68.31 -54.36 17.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.376 -0.827 . . . . 0.0 110.232 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.523 ' HE3' HG12 ' A' ' 123' ' ' VAL . 2.3 mpp? -47.09 -38.13 10.82 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.382 -0.823 . . . . 0.0 110.34 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.6 m -67.18 -38.77 85.95 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.165 -0.959 . . . . 0.0 110.212 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.52 ' CD2' HD12 ' A' ' 60' ' ' ILE . 16.7 tp -65.85 -64.58 0.83 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.224 -0.922 . . . . 0.0 109.138 179.119 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.551 ' HG3' ' CD2' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -51.86 -27.15 11.72 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.268 -0.895 . . . . 0.0 110.331 179.536 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.53 ' CA ' HD23 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -75.84 -35.47 59.96 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.006 -1.059 . . . . 0.0 110.035 179.629 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.56 ' CE2' HG23 ' A' ' 87' ' ' THR . 33.8 t80 -75.81 -58.21 3.42 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.403 -0.811 . . . . 0.0 110.58 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.561 HD22 ' HB1' ' A' ' 44' ' ' ALA . 5.3 mt -46.72 -48.49 20.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.169 -0.957 . . . . 0.0 109.83 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.549 HD12 HD13 ' A' ' 130' ' ' LEU . 63.1 mt -48.23 -43.05 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.107 -0.996 . . . . 0.0 110.322 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.3 tttp -75.55 -78.0 0.12 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.251 -0.906 . . . . 0.0 110.717 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.56 HG23 ' CE2' ' A' ' 83' ' ' TYR . 7.8 t -86.01 -25.61 25.87 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.159 -0.963 . . . . 0.0 110.764 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.558 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -43.48 -80.13 0.05 OUTLIER Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.4 t -172.25 161.6 5.38 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.175 -1.191 . . . . 0.0 110.194 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.4 -27.04 68.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.206 -0.934 . . . . 0.0 110.186 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.442 ' HG3' ' CD2' ' A' ' 53' ' ' PHE . 9.9 ptp180 -72.75 -34.67 67.18 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.197 -0.939 . . . . 0.0 109.852 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.603 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 54.0 t -58.4 -51.63 69.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.284 -0.885 . . . . 0.0 109.942 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.411 ' HA ' HG12 ' A' ' 85' ' ' ILE . 5.3 t -58.46 -41.36 85.02 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.177 -0.952 . . . . 0.0 109.71 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -57.95 -40.07 79.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.226 -0.921 . . . . 0.0 109.795 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.477 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 6.4 tp-100 -67.53 -39.37 85.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.315 -0.866 . . . . 0.0 109.397 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 2.7 t -56.59 -31.95 64.76 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.221 -0.924 . . . . 0.0 108.831 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.443 ' HA ' ' SD ' ' A' ' 100' ' ' MET . 0.8 OUTLIER -81.42 -24.92 36.58 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.512 -0.742 . . . . 0.0 109.771 179.333 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.512 ' HG3' ' N ' ' A' ' 99' ' ' ASN . 0.1 OUTLIER -77.94 -22.84 48.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.245 -0.909 . . . . 0.0 109.743 179.736 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' A' ' 98' ' ' GLU . 8.4 t30 -132.19 38.53 3.48 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.555 -0.716 . . . . 0.0 109.797 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.443 ' SD ' ' HA ' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -60.53 -34.72 74.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.834 . . . . 0.0 109.908 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.446 ' O ' ' HB ' ' A' ' 105' ' ' THR . 66.3 m-85 -57.08 -27.96 62.18 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.301 -0.874 . . . . 0.0 109.688 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.519 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -71.93 -42.86 66.15 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.459 -0.775 . . . . 0.0 110.077 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.463 ' O ' ' HB3' ' A' ' 127' ' ' ALA . 6.2 t -68.81 -28.16 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.446 ' HG2' HG22 ' A' ' 131' ' ' VAL . 1.2 mm100 -90.37 -20.66 22.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.915 . . . . 0.0 110.449 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.519 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 6.2 t -61.32 -22.44 64.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.198 -0.939 . . . . 0.0 110.24 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.728 HD12 HD21 ' A' ' 64' ' ' LEU . 35.3 mt -61.44 -39.12 89.65 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 110.204 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.467 ' HA ' ' HB2' ' A' ' 124' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.209 -0.932 . . . . 0.0 110.146 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.552 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.391 0.615 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.552 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 2.6 m-80 -37.72 -28.31 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.816 -0.552 . . . . 0.0 110.804 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.552 ' CG1' HG13 ' A' ' 74' ' ' VAL . 3.8 t -81.72 -58.72 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.188 -0.945 . . . . 0.0 110.382 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -50.62 -30.96 14.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.222 -0.924 . . . . 0.0 110.799 -179.476 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -81.45 -53.76 6.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.221 -0.925 . . . . 0.0 111.169 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.523 ' HG2' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -51.64 -47.12 63.85 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.081 -1.012 . . . . 0.0 110.593 -179.465 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.506 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -67.65 -41.55 83.63 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.3 -0.875 . . . . 0.0 111.003 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 124' ' ' ARG . 0.2 OUTLIER -58.53 -43.84 89.37 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.074 -1.016 . . . . 0.0 110.884 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.452 ' N ' ' OE1' ' A' ' 129' ' ' GLN . 0.5 OUTLIER -64.94 -49.44 70.36 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.086 -1.009 . . . . 0.0 110.803 -179.519 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.551 ' CD2' ' HG3' ' A' ' 81' ' ' MET . 12.1 tp -51.26 -41.69 60.55 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.062 -1.024 . . . . 0.0 110.258 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.446 HG22 ' HG2' ' A' ' 104' ' ' GLN . 25.3 t -66.3 -32.77 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.252 -0.905 . . . . 0.0 109.878 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.9 -51.71 56.32 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.145 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.43 ' O ' ' C ' ' A' ' 134' ' ' LEU . 0.5 OUTLIER -61.69 -42.07 98.43 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.323 -0.86 . . . . 0.0 110.446 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.488 ' CD2' HD11 ' A' ' 85' ' ' ILE . 1.5 mm? . . . . . 0 N--CA 1.491 1.621 0 O-C-N 121.309 -0.87 . . . . 0.0 110.299 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.242 0.544 . . . . 0.0 110.385 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.495 ' HB1' HG13 ' A' ' 56' ' ' ILE . . . -58.91 -47.22 85.78 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.297 -0.877 . . . . 0.0 110.182 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.401 ' HG3' HG12 ' A' ' 22' ' ' ILE . 10.4 pt-20 -45.22 -30.95 1.33 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.275 -0.891 . . . . 0.0 109.991 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.401 HG12 ' HG3' ' A' ' 21' ' ' GLU . 27.9 mm -75.5 -44.74 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.345 -0.847 . . . . 0.0 110.038 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.457 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 2.9 mmtp -55.53 -51.88 65.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.244 -0.91 . . . . 0.0 110.003 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.547 HG21 HG23 ' A' ' 56' ' ' ILE . 98.7 t -58.57 -37.63 66.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.224 -0.923 . . . . 0.0 110.064 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -69.05 0.13 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.253 -0.904 . . . . 0.0 109.977 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -64.08 -13.64 48.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.423 -0.798 . . . . 0.0 110.199 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.528 ' HB1' ' CD1' ' A' ' 39' ' ' LEU . . . -77.0 -30.3 55.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.249 -0.907 . . . . 0.0 110.082 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.453 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 32.7 p . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.304 -0.872 . . . . 0.0 110.031 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.528 ' CD1' ' HB1' ' A' ' 27' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.232 0.539 . . . . 0.0 110.247 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.35 -53.75 9.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.268 -0.895 . . . . 0.0 110.235 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.3 t -56.75 -27.46 59.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.198 -0.939 . . . . 0.0 110.207 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.16 -50.19 12.43 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.3 -0.875 . . . . 0.0 110.233 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.519 HG22 ' CD1' ' A' ' 84' ' ' LEU . 82.1 mt -56.31 -36.48 46.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.201 -0.937 . . . . 0.0 110.012 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.546 ' HB2' HD21 ' A' ' 84' ' ' LEU . . . -67.65 -49.85 60.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.303 -0.873 . . . . 0.0 109.654 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.444 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 25.8 t70 -55.31 -18.86 7.12 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.124 -0.985 . . . . 0.0 109.141 179.129 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.473 ' O ' ' HB2' ' A' ' 49' ' ' ASN . 10.7 mt -85.32 -34.22 21.91 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.529 -0.732 . . . . 0.0 110.119 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.482 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 76.1 p -56.23 -41.08 75.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.153 -0.967 . . . . 0.0 109.521 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.582 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 85.4 m-85 -43.3 -43.69 5.06 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 119.776 -0.77 . . . . 0.0 109.195 179.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 46' ' ' LEU . 5.6 m-20 -58.87 -160.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.662 0.744 . . . . 0.0 110.051 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.424 HG21 ' N ' ' A' ' 51' ' ' VAL . 3.0 m -122.01 -32.35 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -178.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 52' ' ' ALA . 10.6 t -85.64 -70.86 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 CA-C-O 121.947 0.88 . . . . 0.0 109.806 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.56 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -38.31 -40.38 0.52 Allowed 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.787 -177.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.482 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 7.4 t80 -55.39 -58.86 6.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.257 -0.902 . . . . 0.0 110.291 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 58' ' ' SER . 67.3 m -55.62 -41.08 72.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.18 -0.95 . . . . 0.0 110.086 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.6 -25.08 67.24 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.359 -0.838 . . . . 0.0 109.971 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.547 HG23 HG21 ' A' ' 24' ' ' VAL . 10.8 mt -79.33 -70.4 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.404 -0.81 . . . . 0.0 110.144 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 15.3 mtp -47.96 -39.82 20.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.192 -0.943 . . . . 0.0 109.596 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.419 ' HB2' ' O ' ' A' ' 54' ' ' SER . 38.5 t -53.42 -57.29 11.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.325 -0.86 . . . . 0.0 109.762 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.421 ' HB3' HG11 ' A' ' 24' ' ' VAL . 8.8 mmt -62.17 -23.17 66.44 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.232 -0.918 . . . . 0.0 109.596 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.556 HG21 HD13 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -72.42 -31.74 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.405 -0.81 . . . . 0.0 109.29 179.524 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -74.7 -44.99 47.29 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.352 -0.842 . . . . 0.0 109.722 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.59 -52.93 61.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.254 -0.904 . . . . 0.0 109.705 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.497 ' HD3' ' CD2' ' A' ' 73' ' ' HIS . 14.5 mmp_? -62.7 -35.79 80.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.229 -0.92 . . . . 0.0 109.713 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.609 HD21 ' CD1' ' A' ' 106' ' ' LEU . 4.1 mt -54.4 -24.02 18.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.351 -0.843 . . . . 0.0 110.052 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.7 t30 . . . . . 0 C--N 1.299 -1.615 0 O-C-N 121.469 -0.769 . . . . 0.0 109.141 179.915 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.497 ' CE3' ' O ' ' A' ' 71' ' ' TRP . 58.4 p-90 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 121.137 0.494 . . . . 0.0 110.468 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.0 mmt180 -71.44 -70.35 0.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.188 -0.945 . . . . 0.0 110.492 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.497 ' CD2' ' HD3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -55.98 -49.46 73.52 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.214 -0.929 . . . . 0.0 110.138 -179.851 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.537 HG12 ' CG1' ' A' ' 123' ' ' VAL . 68.8 t -44.0 -53.01 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.434 -0.791 . . . . 0.0 110.488 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.493 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 5.3 t80 -49.68 -56.27 10.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.273 -0.892 . . . . 0.0 110.196 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.453 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -56.59 -28.53 60.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.201 -0.937 . . . . 0.0 110.144 179.945 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.55 ' HB3' ' CD2' ' A' ' 64' ' ' LEU . . . -71.14 -34.92 71.48 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.361 -0.837 . . . . 0.0 109.81 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.531 ' HE2' ' CG1' ' A' ' 74' ' ' VAL . 0.6 OUTLIER -61.8 -38.9 89.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.472 -0.768 . . . . 0.0 109.715 179.52 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 40.9 m -61.04 -63.91 1.13 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.278 -0.889 . . . . 0.0 110.058 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.539 ' CD2' HD12 ' A' ' 60' ' ' ILE . 20.1 tp -47.35 -54.1 12.03 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.212 -0.93 . . . . 0.0 110.068 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.521 ' HG2' ' CD2' ' A' ' 130' ' ' LEU . 3.7 ttp -50.76 -37.25 40.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.193 -0.942 . . . . 0.0 110.365 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.475 ' HA ' HD13 ' A' ' 85' ' ' ILE . 26.2 tt0 -74.17 -68.58 0.51 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.096 -1.003 . . . . 0.0 110.574 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.561 ' CE2' HG23 ' A' ' 87' ' ' THR . 55.0 t80 -37.58 -45.91 0.8 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.494 -0.754 . . . . 0.0 111.367 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.546 HD21 ' HB2' ' A' ' 44' ' ' ALA . 75.6 mt -66.68 -42.31 86.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.14 -0.975 . . . . 0.0 110.695 -179.243 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.526 ' N ' HG13 ' A' ' 92' ' ' VAL . 32.3 mt -52.73 -19.91 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 120.933 -1.104 . . . . 0.0 110.158 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.82 -87.96 0.44 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.297 -0.877 . . . . 0.0 110.293 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.561 HG23 ' CE2' ' A' ' 83' ' ' TYR . 14.9 t -69.41 -6.21 28.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.224 -0.922 . . . . 0.0 110.222 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.582 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -72.19 -78.74 0.48 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.3 t -174.81 157.01 2.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.11 -1.229 . . . . 0.0 110.234 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.92 -21.84 65.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.302 -0.874 . . . . 0.0 110.191 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.28 -39.5 59.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.22 -0.925 . . . . 0.0 110.08 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.526 HG13 ' N ' ' A' ' 85' ' ' ILE . 78.4 t -58.69 -31.48 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.289 -0.882 . . . . 0.0 110.074 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 29.6 p -79.06 -38.69 35.79 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.159 -0.963 . . . . 0.0 110.018 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -59.67 -59.37 5.55 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.283 -0.885 . . . . 0.0 109.832 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.42 -35.85 63.37 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.481 -0.762 . . . . 0.0 109.8 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.467 ' SG ' HD11 ' A' ' 85' ' ' ILE . 11.6 m -60.91 -36.38 79.12 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.19 -0.944 . . . . 0.0 109.713 179.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -73.83 -26.63 60.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.403 -0.811 . . . . 0.0 109.589 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -81.85 -22.84 36.76 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.373 -0.829 . . . . 0.0 110.057 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -111.52 34.75 3.95 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.286 -0.884 . . . . 0.0 110.34 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.535 ' HE3' ' CZ ' ' A' ' 101' ' ' TYR . 5.6 ptp -60.97 -31.06 70.65 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.215 -0.928 . . . . 0.0 110.17 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.535 ' CZ ' ' HE3' ' A' ' 100' ' ' MET . 32.1 m-85 -61.42 -26.27 67.75 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.888 . . . . 0.0 110.2 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.521 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -76.65 -40.75 48.15 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.244 -0.91 . . . . 0.0 110.15 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.509 ' HB ' ' CG2' ' A' ' 131' ' ' VAL . 5.3 t -72.12 -27.46 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.376 -0.828 . . . . 0.0 110.151 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.471 ' HG2' HG23 ' A' ' 131' ' ' VAL . 15.5 mm-40 -82.18 -26.89 32.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.174 -0.954 . . . . 0.0 110.315 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.521 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 7.1 t -64.85 -12.64 50.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.128 -0.983 . . . . 0.0 110.04 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.609 ' CD1' HD21 ' A' ' 64' ' ' LEU . 65.4 mt -77.23 -33.17 56.18 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.274 -0.891 . . . . 0.0 110.181 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.525 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 1.2 ttmt . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.378 -0.827 . . . . 0.0 110.464 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.542 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 2.8 p . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 121.277 0.561 . . . . 0.0 110.146 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.542 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.0 OUTLIER -36.13 -31.2 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.833 -0.542 . . . . 0.0 110.775 -179.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.537 ' CG1' HG12 ' A' ' 74' ' ' VAL . 1.0 OUTLIER -82.19 -46.07 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.263 -0.898 . . . . 0.0 109.917 179.783 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.525 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -57.35 -30.88 65.2 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.203 -0.936 . . . . 0.0 110.61 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.451 ' OE1' HG11 ' A' ' 121' ' ' VAL . 44.8 mt-10 -82.71 -54.75 4.89 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.196 -0.94 . . . . 0.0 111.055 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.493 ' HG3' ' CE1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -52.62 -49.64 64.71 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.096 -1.002 . . . . 0.0 110.235 -179.631 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.504 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -61.14 -41.62 97.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.314 -0.866 . . . . 0.0 110.431 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 124' ' ' ARG . 2.4 ttmt -56.9 -49.66 74.91 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.161 -0.962 . . . . 0.0 110.369 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -55.2 -49.59 71.54 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 110.379 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.526 ' O ' ' CD1' ' A' ' 134' ' ' LEU . 0.3 OUTLIER -53.29 -40.82 65.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.161 -0.962 . . . . 0.0 110.161 -179.916 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.509 ' CG2' ' HB ' ' A' ' 103' ' ' VAL . 26.4 t -72.75 -25.91 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.356 -0.84 . . . . 0.0 110.191 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.23 -56.17 7.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.218 -0.926 . . . . 0.0 110.389 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 15.7 tp -69.9 -37.8 76.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.289 -0.882 . . . . 0.0 110.377 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.526 ' CD1' ' O ' ' A' ' 130' ' ' LEU . 30.9 mt . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.154 -0.966 . . . . 0.0 110.206 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.21 0.528 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.463 ' CB ' HD23 ' A' ' 46' ' ' LEU . . . -65.01 -52.97 53.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.233 -0.917 . . . . 0.0 110.15 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.409 ' CG ' ' N ' ' A' ' 22' ' ' ILE . 12.5 pt-20 -50.1 -34.1 20.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.236 -0.915 . . . . 0.0 110.053 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.409 ' N ' ' CG ' ' A' ' 21' ' ' GLU . 13.4 mt -66.07 -39.41 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.255 -0.903 . . . . 0.0 109.934 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.437 ' CB ' HG12 ' A' ' 43' ' ' ILE . 1.6 mmtm -67.11 -39.55 86.69 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.296 -0.877 . . . . 0.0 110.017 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.528 HG21 HG23 ' A' ' 56' ' ' ILE . 56.1 t -57.83 -38.68 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.353 -0.842 . . . . 0.0 110.091 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.472 ' HD3' ' CZ ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -63.35 -50.68 69.01 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.281 -0.887 . . . . 0.0 110.157 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 49.1 tt0 -68.95 -17.05 63.89 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.432 -0.793 . . . . 0.0 109.959 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.488 ' CB ' ' CD2' ' A' ' 39' ' ' LEU . . . -79.78 -33.16 40.79 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.343 -0.848 . . . . 0.0 110.147 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.457 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 82.3 p . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.211 -0.93 . . . . 0.0 110.107 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.488 ' CD2' ' CB ' ' A' ' 27' ' ' ALA . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.283 0.563 . . . . 0.0 110.22 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 5.4 mtt -67.48 -62.2 1.53 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.171 -0.955 . . . . 0.0 110.234 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.44 -24.2 7.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.263 -0.898 . . . . 0.0 110.267 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.83 -54.02 8.06 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.156 -0.965 . . . . 0.0 110.176 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.472 ' O ' ' HB2' ' A' ' 46' ' ' LEU . 79.3 mt -52.96 -32.85 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.149 -0.969 . . . . 0.0 109.951 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.55 ' HB3' HD21 ' A' ' 84' ' ' LEU . . . -70.23 -52.91 19.54 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.182 -0.949 . . . . 0.0 109.62 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.568 ' HA ' ' CD1' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -51.55 -21.46 2.52 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.021 -1.049 . . . . 0.0 109.455 179.268 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 43' ' ' ILE . 4.6 mt -76.92 -40.97 45.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.429 -0.794 . . . . 0.0 110.133 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.521 HG23 ' CD1' ' A' ' 56' ' ' ILE . 42.9 p -53.97 -43.07 69.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.257 -0.902 . . . . 0.0 109.712 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.568 ' CD1' ' HA ' ' A' ' 45' ' ' ASP . 81.6 m-85 -40.48 -38.96 0.92 Allowed 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 119.945 -0.702 . . . . 0.0 109.529 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.466 ' O ' ' O ' ' A' ' 48' ' ' TYR . 13.7 m120 -58.08 -152.71 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.69 0.757 . . . . 0.0 110.168 179.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.7 t -128.11 -15.89 2.68 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.275 -177.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.646 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 0.3 OUTLIER -110.14 -48.1 6.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 CA-C-O 122.42 1.105 . . . . 0.0 108.569 179.151 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.646 ' N ' ' CG1' ' A' ' 51' ' ' VAL . . . -48.82 -47.27 42.54 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.37 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.509 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 2.1 t80 -56.88 -54.7 43.48 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.374 -0.829 . . . . 0.0 109.819 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.88 -21.62 61.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.276 -0.89 . . . . 0.0 110.325 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' A' ' 51' ' ' VAL . 2.8 mm-40 -90.72 -19.6 23.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.309 -0.87 . . . . 0.0 110.048 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.528 HG23 HG21 ' A' ' 24' ' ' VAL . 7.3 mt -80.77 -70.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.383 -0.823 . . . . 0.0 110.0 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.574 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 95.8 mmm -45.17 -35.57 3.31 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -56.9 -59.56 4.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.345 -0.847 . . . . 0.0 109.806 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.459 ' HB3' HG11 ' A' ' 24' ' ' VAL . 0.0 OUTLIER -59.08 -25.64 63.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.333 -0.854 . . . . 0.0 109.966 179.653 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.537 HG21 HD11 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -74.15 -29.97 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.364 -0.835 . . . . 0.0 109.936 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.574 ' CD1' ' O ' ' A' ' 57' ' ' MET . 18.2 m95 -76.07 -44.76 37.43 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.158 -0.964 . . . . 0.0 110.387 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -49.06 79.11 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.222 -0.924 . . . . 0.0 110.434 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.472 ' CZ ' ' HD3' ' A' ' 25' ' ' ARG . 12.5 mmt85 -70.6 -32.02 69.23 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.22 -0.925 . . . . 0.0 110.32 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.561 HD22 ' CD1' ' A' ' 106' ' ' LEU . 3.9 mt -57.0 -18.67 14.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.319 -0.863 . . . . 0.0 110.503 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.0 t30 . . . . . 0 C--N 1.301 -1.504 0 O-C-N 121.238 -0.914 . . . . 0.0 109.935 -179.953 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 47.4 p-90 . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.203 0.525 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.429 ' HG3' ' N ' ' A' ' 73' ' ' HIS . 1.3 ptp180 -55.56 -27.11 47.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.255 -0.903 . . . . 0.0 110.224 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.429 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -72.71 -36.14 67.74 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 109.986 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.534 HG11 ' CG1' ' A' ' 123' ' ' VAL . 55.6 t -62.62 -59.16 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.318 -0.864 . . . . 0.0 110.024 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.639 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 15.8 t80 -46.78 -43.57 18.36 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.253 -0.904 . . . . 0.0 110.055 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.457 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 7.5 mmtp -65.18 -37.11 86.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.256 -0.902 . . . . 0.0 110.166 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.552 ' HB1' HD21 ' A' ' 64' ' ' LEU . . . -65.9 -27.24 68.05 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.224 -0.922 . . . . 0.0 110.015 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.537 ' CE ' HG13 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -71.4 -39.39 71.17 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.363 -0.836 . . . . 0.0 110.396 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 39.1 m -63.68 -35.81 81.77 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.168 -0.958 . . . . 0.0 110.129 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.525 ' CD2' HD13 ' A' ' 60' ' ' ILE . 33.3 tp -75.98 -37.38 58.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.145 -0.972 . . . . 0.0 109.614 179.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.465 ' O ' HG13 ' A' ' 85' ' ' ILE . 3.4 ttp -72.7 -20.85 61.15 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.269 -0.894 . . . . 0.0 109.97 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.543 ' CA ' HD13 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -89.79 -36.29 15.22 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.266 -0.896 . . . . 0.0 110.244 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.633 ' CE1' ' CG2' ' A' ' 87' ' ' THR . 22.6 t80 -73.25 -42.25 62.76 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.363 -0.835 . . . . 0.0 110.698 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.55 HD21 ' HB3' ' A' ' 44' ' ' ALA . 57.4 mt -67.4 -30.12 69.79 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.255 -0.903 . . . . 0.0 110.365 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.564 ' N ' HG13 ' A' ' 92' ' ' VAL . 17.7 mt -68.66 -13.11 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.084 -1.01 . . . . 0.0 110.039 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.67 -66.96 0.91 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 109.971 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.633 ' CG2' ' CE1' ' A' ' 83' ' ' TYR . 11.5 t -97.13 8.11 45.21 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.341 -0.849 . . . . 0.0 109.94 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.543 ' O ' ' CG2' ' A' ' 92' ' ' VAL . . . -95.93 30.81 7.97 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.516 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.8 OUTLIER 72.29 156.98 0.17 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.305 -1.115 . . . . 0.0 110.288 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.43 -9.96 52.01 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.275 -0.89 . . . . 0.0 110.507 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.4 ' O ' ' HB2' ' A' ' 94' ' ' GLN . 2.2 mmt180 -69.59 -45.53 68.39 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.305 -0.872 . . . . 0.0 109.638 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.564 HG13 ' N ' ' A' ' 85' ' ' ILE . 99.3 t -52.76 -40.53 35.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 121.503 -0.748 . . . . 0.0 109.768 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.8 m -68.48 -39.32 81.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.296 -0.878 . . . . 0.0 109.506 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 91' ' ' ARG . 8.7 mt-30 -55.85 -35.5 66.5 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.331 -0.856 . . . . 0.0 109.397 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.478 ' HA ' ' HG2' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -70.08 -40.2 75.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.451 -0.78 . . . . 0.0 109.014 178.956 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 21.7 t -55.3 -31.95 62.05 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.239 -0.913 . . . . 0.0 108.959 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.9 mttt -82.14 -25.87 34.0 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.567 -0.708 . . . . 0.0 109.924 179.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.509 ' HG3' ' N ' ' A' ' 99' ' ' ASN . 0.0 OUTLIER -75.36 -21.98 57.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 109.856 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.509 ' N ' ' HG3' ' A' ' 98' ' ' GLU . 22.6 t-20 -140.77 44.79 1.82 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.407 -0.808 . . . . 0.0 109.977 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 28.5 ttp -59.92 -36.07 76.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.908 . . . . 0.0 110.025 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.439 ' N ' ' CD1' ' A' ' 101' ' ' TYR . 8.7 m-30 -57.62 -27.04 62.42 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.389 -0.819 . . . . 0.0 109.972 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.525 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -69.06 -41.5 77.51 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.385 -0.822 . . . . 0.0 110.085 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.445 HG13 HG23 ' A' ' 131' ' ' VAL . 3.4 t -73.88 -29.7 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.373 -0.83 . . . . 0.0 109.84 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.462 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 7.5 mt-30 -83.45 -20.18 34.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.417 -0.802 . . . . 0.0 110.219 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.525 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 6.5 t -72.34 -20.0 61.55 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.255 -0.903 . . . . 0.0 110.19 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.561 ' CD1' HD22 ' A' ' 64' ' ' LEU . 12.2 mt -64.3 -39.75 94.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.267 -0.896 . . . . 0.0 109.937 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.271 -0.893 . . . . 0.0 110.143 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.564 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.6 p . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 121.315 0.579 . . . . 0.0 110.223 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.564 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.7 OUTLIER -39.37 -44.01 1.27 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.59 -0.694 . . . . 0.0 110.61 -179.843 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.537 HG13 ' CE ' ' A' ' 78' ' ' MET . 1.4 t -78.86 -48.67 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.339 -0.85 . . . . 0.0 110.202 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.471 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -44.04 -51.05 8.14 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.272 -0.893 . . . . 0.0 111.201 -179.365 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.457 ' OE2' ' HA ' ' A' ' 122' ' ' ASN . 14.2 pt-20 -72.72 -34.26 66.99 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.273 -0.892 . . . . 0.0 111.186 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.639 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -59.04 -54.6 45.29 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.972 -1.08 . . . . 0.0 110.289 -179.776 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.486 ' CB ' ' SD ' ' A' ' 78' ' ' MET . . . -59.83 -42.94 94.66 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.338 -0.851 . . . . 0.0 110.488 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -60.5 -34.62 74.34 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.236 -0.915 . . . . 0.0 110.477 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 132' ' ' ALA . 1.9 mt-30 -65.48 -42.87 91.72 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.298 -0.876 . . . . 0.0 110.48 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.543 HD13 ' CA ' ' A' ' 82' ' ' GLU . 0.4 OUTLIER -58.14 -56.09 26.53 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.034 -1.042 . . . . 0.0 109.948 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.445 HG23 HG13 ' A' ' 103' ' ' VAL . 55.4 t -53.78 -23.6 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.449 -0.782 . . . . 0.0 109.837 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' A' ' 129' ' ' GLN . . . -76.22 -56.12 4.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.447 -0.783 . . . . 0.0 110.503 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.98 -34.16 54.67 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.342 -0.849 . . . . 0.0 110.582 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.495 ' CD1' HG21 ' A' ' 85' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.188 -0.945 . . . . 0.0 110.451 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.429 ' OE1' HD23 ' A' ' 46' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 121.173 0.511 . . . . 0.0 110.675 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.462 ' HA ' HD12 ' A' ' 46' ' ' LEU . . . -71.16 -55.23 8.58 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.193 -0.942 . . . . 0.0 110.625 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.442 ' HG3' HG12 ' A' ' 22' ' ' ILE . 19.7 pt-20 -41.01 -27.45 0.06 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.291 -0.881 . . . . 0.0 110.461 -179.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.443 ' N ' ' O ' ' A' ' 20' ' ' ALA . 23.5 mm -82.74 -57.81 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.271 -0.893 . . . . 0.0 110.308 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.434 ' HB3' HG13 ' A' ' 43' ' ' ILE . 26.2 mttt -53.9 -19.05 3.96 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.241 -0.912 . . . . 0.0 110.409 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.475 HG23 HG12 ' A' ' 43' ' ' ILE . 6.7 t -89.32 -37.39 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.204 -0.935 . . . . 0.0 110.12 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.501 ' NH2' ' NH1' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -64.66 -36.95 85.93 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.295 -0.878 . . . . 0.0 110.228 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -85.19 -40.56 16.55 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.273 -0.892 . . . . 0.0 110.259 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.523 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . . . -49.48 -38.51 30.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 0.0 110.174 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.467 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 63.6 p . . . . . 0 N--CA 1.492 1.67 0 O-C-N 121.307 -0.87 . . . . 0.0 110.25 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.523 ' CD1' ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.247 0.546 . . . . 0.0 110.319 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.555 ' HG3' ' CG ' ' A' ' 83' ' ' TYR . 36.2 tpp -82.17 -60.14 2.32 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.532 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 7.8 t -56.89 -21.51 30.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.303 -0.873 . . . . 0.0 110.267 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -76.51 -55.78 5.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -0.906 . . . . 0.0 110.221 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.523 HD11 ' CD1' ' A' ' 39' ' ' LEU . 36.2 mt -49.03 -36.64 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.18 -0.95 . . . . 0.0 110.157 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.575 ' HB3' HD23 ' A' ' 84' ' ' LEU . . . -67.63 -55.0 15.04 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.204 -0.935 . . . . 0.0 109.489 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -50.08 -23.45 2.11 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.097 -1.002 . . . . 0.0 109.14 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.471 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 7.4 mt -79.1 -40.35 31.36 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.581 -0.699 . . . . 0.0 109.91 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.532 HG23 HG23 ' A' ' 92' ' ' VAL . 80.7 p -47.54 -39.71 17.07 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.177 -0.952 . . . . 0.0 109.174 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.575 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 57.9 m-85 -46.06 -50.3 15.36 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 119.384 -0.926 . . . . 0.0 109.289 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.529 ' O ' ' C ' ' A' ' 50' ' ' VAL . 16.5 m-20 -68.14 91.21 0.35 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.57 0.7 . . . . 0.0 110.765 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.529 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -11.0 -57.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.712 178.138 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.558 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -64.92 -66.25 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 120.928 -1.108 . . . . 0.0 110.301 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.558 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -37.57 -40.45 0.39 Allowed 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 121.146 0.498 . . . . 0.0 110.762 -177.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.573 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 15.1 t80 -59.07 -54.01 51.9 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.334 -0.854 . . . . 0.0 109.998 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.5 t -55.97 -33.22 64.58 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.19 -0.944 . . . . 0.0 109.862 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -75.42 -27.1 58.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.327 -0.858 . . . . 0.0 109.898 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.515 HG21 ' CD1' ' A' ' 84' ' ' LEU . 8.7 mt -79.68 -70.13 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.394 -0.816 . . . . 0.0 110.026 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.573 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 75.3 mmm -46.59 -36.35 6.8 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.274 -0.891 . . . . 0.0 109.563 179.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.4 m -55.16 -62.49 1.63 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.366 -0.834 . . . . 0.0 109.939 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.419 ' CA ' ' HE3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -59.35 -21.4 59.76 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.188 -0.945 . . . . 0.0 109.798 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.533 HD13 HD23 ' A' ' 80' ' ' LEU . 1.0 OUTLIER -76.08 -30.29 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.41 -0.806 . . . . 0.0 109.748 179.871 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.557 ' CE3' HD12 ' A' ' 64' ' ' LEU . 14.0 m95 -76.13 -46.73 27.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.307 -0.87 . . . . 0.0 110.346 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.3 mptt -55.84 -47.67 76.83 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.25 -0.906 . . . . 0.0 110.392 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.501 ' NH1' ' NH2' ' A' ' 25' ' ' ARG . 6.0 mmp_? -75.88 -10.9 59.81 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.326 -0.859 . . . . 0.0 110.338 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.699 HD23 HD13 ' A' ' 106' ' ' LEU . 6.6 mt -83.55 -17.68 40.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.194 -0.941 . . . . 0.0 110.351 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.5 m-20 . . . . . 0 C--N 1.302 -1.464 0 O-C-N 121.329 -0.857 . . . . 0.0 110.073 -179.567 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.571 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 28.7 p-90 . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.21 0.529 . . . . 0.0 110.332 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.571 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 15.2 mtm-85 -48.85 -40.8 30.91 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.208 -0.933 . . . . 0.0 110.235 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 17.0 m170 -68.04 -47.81 67.37 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.234 -0.917 . . . . 0.0 110.094 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.544 HG13 ' HE2' ' A' ' 78' ' ' MET . 7.0 t -46.37 -52.42 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.349 -0.844 . . . . 0.0 110.172 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.53 ' CZ ' ' ND2' ' A' ' 122' ' ' ASN . 19.8 t80 -54.87 -49.05 72.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.342 -0.849 . . . . 0.0 110.33 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.467 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 10.9 mttm -61.92 -22.81 65.9 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.24 -0.913 . . . . 0.0 110.091 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.539 ' CB ' ' HG ' ' A' ' 64' ' ' LEU . . . -80.05 -23.92 41.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.239 -0.913 . . . . 0.0 109.936 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.544 ' HE2' HG13 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -73.81 -38.45 64.57 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.332 -0.855 . . . . 0.0 110.004 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.488 HG21 ' N ' ' A' ' 80' ' ' LEU . 8.9 t -72.1 -34.32 68.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.207 -0.933 . . . . 0.0 110.046 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.533 HD23 HD13 ' A' ' 60' ' ' ILE . 10.1 tp -68.41 -62.0 1.59 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.232 -0.917 . . . . 0.0 108.994 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.456 ' O ' HG13 ' A' ' 85' ' ' ILE . 2.9 ttm -53.69 -32.32 51.29 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.406 -0.808 . . . . 0.0 109.9 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.449 ' HG3' HD11 ' A' ' 130' ' ' LEU . 2.8 tt0 -72.74 -32.82 65.96 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.247 -0.908 . . . . 0.0 109.634 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.555 ' CG ' ' HG3' ' A' ' 40' ' ' MET . 20.9 t80 -70.75 -38.88 73.53 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.543 -0.723 . . . . 0.0 110.487 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.575 HD23 ' HB3' ' A' ' 44' ' ' ALA . 1.7 mt -70.55 -32.98 70.62 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.107 -0.995 . . . . 0.0 109.578 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.499 ' N ' HG12 ' A' ' 92' ' ' VAL . 71.5 mt -61.76 -26.34 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.181 -0.949 . . . . 0.0 110.082 179.654 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.02 -70.64 0.62 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.385 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.464 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 13.0 t -94.1 -23.05 18.12 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.236 -0.915 . . . . 0.0 110.4 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.575 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -44.36 -84.54 0.01 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.459 ' HB3' ' O ' ' A' ' 88' ' ' GLY . 14.4 p -178.09 156.37 1.02 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.234 -1.156 . . . . 0.0 110.31 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.78 -21.56 11.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.282 -0.886 . . . . 0.0 110.2 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -70.74 -44.84 65.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.928 . . . . 0.0 109.86 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.564 HG22 ' CE1' ' A' ' 53' ' ' PHE . 55.2 t -53.27 -38.45 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.361 -0.837 . . . . 0.0 109.958 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 96' ' ' CYS . 70.5 m -70.79 -41.06 72.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.316 -0.865 . . . . 0.0 109.98 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 31.3 mm-40 -57.07 -54.88 41.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.304 -0.872 . . . . 0.0 109.992 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.9 tp60 -55.86 -36.8 67.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.424 -0.797 . . . . 0.0 109.877 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 93' ' ' SER . 4.8 m -60.15 -36.37 77.38 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.315 -0.865 . . . . 0.0 109.736 179.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -74.92 -31.8 61.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.683 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 82.2 mt-10 -81.23 -14.78 57.13 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.473 -0.767 . . . . 0.0 110.027 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -123.18 32.87 5.54 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.281 -0.887 . . . . 0.0 110.174 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.6 ttm -58.2 -24.7 60.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.325 -0.86 . . . . 0.0 110.133 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.453 ' O ' ' HB ' ' A' ' 105' ' ' THR . 14.5 m-85 -69.07 -31.83 70.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.919 . . . . 0.0 110.104 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.527 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -75.08 -40.03 60.36 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.48 -0.763 . . . . 0.0 110.26 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.511 HG11 ' CG2' ' A' ' 131' ' ' VAL . 3.6 t -71.63 -32.37 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.418 -0.801 . . . . 0.0 110.14 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.419 ' HG3' HG23 ' A' ' 131' ' ' VAL . 77.3 mt-30 -86.0 -23.36 26.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.281 -0.887 . . . . 0.0 110.508 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.527 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 7.3 t -51.37 -25.69 6.49 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.082 -1.011 . . . . 0.0 110.002 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.699 HD13 HD23 ' A' ' 64' ' ' LEU . 50.5 mt -62.39 -43.55 98.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.309 -0.869 . . . . 0.0 110.077 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.471 ' HA ' ' HG2' ' A' ' 124' ' ' ARG . 49.0 mttt . . . . . 0 N--CA 1.492 1.634 0 O-C-N 121.191 -0.943 . . . . 0.0 109.965 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.375 0.607 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 3.7 t30 -36.12 -30.33 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.143 0.497 . . . . 0.0 110.582 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.525 HG11 ' CE ' ' A' ' 78' ' ' MET . 4.6 t -78.16 -58.45 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 0.0 109.826 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.471 ' HG2' ' HA ' ' A' ' 107' ' ' LYS . 10.4 mtp-105 -42.1 -47.29 4.52 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.243 -0.91 . . . . 0.0 111.038 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -72.28 -48.56 41.49 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.381 -0.825 . . . . 0.0 111.662 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.513 ' CE ' ' HA ' ' A' ' 126' ' ' LYS . 0.0 OUTLIER -52.04 -53.6 40.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.837 -1.164 . . . . 0.0 110.15 -179.278 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.418 ' HB1' ' HE3' ' A' ' 78' ' ' MET . . . -52.2 -43.25 64.1 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.341 -0.849 . . . . 0.0 110.146 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.3 tmmm? -55.21 -36.59 66.12 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.207 -0.933 . . . . 0.0 110.371 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -57.45 3.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.161 -0.962 . . . . 0.0 110.294 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.488 ' O ' ' CD2' ' A' ' 134' ' ' LEU . 12.2 tp -46.88 -25.5 0.78 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.208 -0.933 . . . . 0.0 110.041 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.511 ' CG2' HG11 ' A' ' 103' ' ' VAL . 30.0 t -86.64 -36.47 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.219 -0.925 . . . . 0.0 110.155 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.73 -60.46 3.07 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.218 -0.927 . . . . 0.0 110.22 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.98 -28.41 9.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.056 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.488 ' CD2' ' O ' ' A' ' 130' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.28 -0.888 . . . . 0.0 110.261 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.36 0.6 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.485 ' HB3' HD12 ' A' ' 46' ' ' LEU . . . -58.53 -46.42 86.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.378 -0.826 . . . . 0.0 110.286 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.474 ' OE2' ' CG1' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -43.71 -28.28 0.4 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.14 -0.975 . . . . 0.0 110.081 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.474 ' CG1' ' OE2' ' A' ' 21' ' ' GLU . 9.9 mt -86.76 -54.08 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.291 -0.881 . . . . 0.0 110.133 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.523 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 0.0 OUTLIER -44.6 -37.87 3.88 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 110.153 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.549 HG23 HG22 ' A' ' 56' ' ' ILE . 51.2 t -75.06 -48.57 31.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.232 -0.917 . . . . 0.0 110.145 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -46.66 -41.19 14.42 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.136 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.461 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -74.05 -47.46 36.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.333 -0.855 . . . . 0.0 110.107 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.537 ' HB3' ' CD2' ' A' ' 39' ' ' LEU . . . -44.44 -47.17 9.88 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.235 -0.916 . . . . 0.0 110.078 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.436 ' HA ' ' HB2' ' A' ' 76' ' ' LYS . 39.5 p . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.32 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.537 ' CD2' ' HB3' ' A' ' 27' ' ' ALA . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.274 0.559 . . . . 0.0 110.25 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -50.67 22.71 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 110.218 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.454 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 89.0 p -58.47 -29.19 65.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -73.11 -47.65 42.47 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.266 -0.896 . . . . 0.0 110.241 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.536 ' CG2' HD13 ' A' ' 80' ' ' LEU . 23.1 mt -57.68 -38.65 65.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.233 -0.917 . . . . 0.0 110.226 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.523 ' HB1' HD23 ' A' ' 84' ' ' LEU . . . -68.61 -47.18 67.34 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.058 -1.027 . . . . 0.0 109.43 179.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.475 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 3.6 t70 -55.41 -18.48 6.94 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.117 -0.99 . . . . 0.0 109.12 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.485 HD12 ' HB3' ' A' ' 20' ' ' ALA . 24.7 mt -85.22 -33.52 22.22 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.531 -0.73 . . . . 0.0 110.191 179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.528 ' HA ' ' CA ' ' A' ' 53' ' ' PHE . 38.9 p -56.08 -43.74 78.31 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.0 -1.062 . . . . 0.0 109.233 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.544 ' CE2' ' O ' ' A' ' 87' ' ' THR . 95.0 m-85 -41.26 -37.51 0.97 Allowed 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.59 179.537 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.542 ' O ' ' C ' ' A' ' 50' ' ' VAL . 0.8 OUTLIER -80.66 91.21 5.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.591 -0.693 . . . . 0.0 110.365 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.542 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.09 -58.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.26 178.095 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.547 HG11 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -65.11 -66.03 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.032 -1.042 . . . . 0.0 110.143 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.547 ' N ' HG11 ' A' ' 51' ' ' VAL . . . -38.19 -44.5 0.86 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.295 0.569 . . . . 0.0 110.522 -177.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.528 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 0.6 OUTLIER -56.73 -55.85 28.88 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.425 -0.797 . . . . 0.0 109.925 179.715 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -54.67 -31.81 58.29 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.194 -0.941 . . . . 0.0 110.232 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -77.79 -26.94 50.04 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.307 -0.871 . . . . 0.0 110.193 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.549 HG22 HG23 ' A' ' 24' ' ' VAL . 6.3 mt -78.36 -70.3 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.326 -0.859 . . . . 0.0 110.216 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.446 ' SD ' ' HB3' ' A' ' 95' ' ' GLN . 3.5 mtp -46.64 -35.48 6.0 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.177 -0.952 . . . . 0.0 109.762 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 t -55.85 -60.97 2.7 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.258 -0.901 . . . . 0.0 109.659 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.45 -20.14 58.86 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.266 -0.897 . . . . 0.0 109.679 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.581 ' CG1' ' CD2' ' A' ' 80' ' ' LEU . 1.2 mt -75.67 -31.18 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.413 -0.804 . . . . 0.0 109.645 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.402 ' CE3' HD13 ' A' ' 64' ' ' LEU . 17.3 m95 -74.74 -50.27 18.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -0.906 . . . . 0.0 110.202 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -56.14 18.4 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.249 -0.907 . . . . 0.0 110.327 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -68.61 -14.18 62.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.246 -0.909 . . . . 0.0 110.427 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.626 HD21 ' CD1' ' A' ' 106' ' ' LEU . 4.1 mt -77.69 -25.25 49.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.22 -0.925 . . . . 0.0 110.569 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.4 m120 . . . . . 0 C--N 1.301 -1.509 0 O-C-N 121.343 -0.848 . . . . 0.0 110.185 -179.638 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.123 0.487 . . . . 0.0 110.25 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -47.5 -35.82 9.37 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.161 -0.962 . . . . 0.0 109.592 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -61.73 -47.86 83.33 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.343 -0.848 . . . . 0.0 109.742 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.538 HG12 ' CG1' ' A' ' 123' ' ' VAL . 58.9 t -50.67 -46.19 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.331 -0.855 . . . . 0.0 109.715 179.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.518 ' CA ' HG21 ' A' ' 123' ' ' VAL . 8.4 t80 -57.18 -52.18 66.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.321 -0.862 . . . . 0.0 109.804 179.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.446 ' O ' HG22 ' A' ' 79' ' ' THR . 25.9 mmmt -62.54 -19.37 63.59 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.298 -0.877 . . . . 0.0 109.768 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.542 ' HB1' HD23 ' A' ' 64' ' ' LEU . . . -79.48 -30.97 42.28 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.399 -0.813 . . . . 0.0 109.927 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.508 ' HE3' ' CG1' ' A' ' 74' ' ' VAL . 1.2 mpp? -68.36 -46.47 70.01 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 109.859 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 76' ' ' LYS . 14.8 t -67.57 -31.86 72.22 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.249 -0.907 . . . . 0.0 109.808 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.581 ' CD2' ' CG1' ' A' ' 60' ' ' ILE . 11.2 tp -66.3 -65.4 0.68 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.347 -0.846 . . . . 0.0 109.033 178.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.514 ' HG2' ' CD2' ' A' ' 130' ' ' LEU . 9.3 ttt -49.38 -32.75 12.1 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.406 -0.809 . . . . 0.0 110.122 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -70.36 -38.07 74.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.102 -0.999 . . . . 0.0 110.025 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.574 ' CE1' HG23 ' A' ' 87' ' ' THR . 19.7 t80 -68.21 -34.31 76.01 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.255 -0.903 . . . . 0.0 110.677 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 84' ' ' LEU . 2.8 mt -80.76 -21.79 40.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.019 -1.051 . . . . 0.0 109.924 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.575 HG23 HD11 ' A' ' 134' ' ' LEU . 19.9 mt -65.93 -24.64 34.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.154 -0.966 . . . . 0.0 109.534 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -103.31 -61.38 1.42 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.361 -0.837 . . . . 0.0 109.901 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.574 HG23 ' CE1' ' A' ' 83' ' ' TYR . 11.0 t -98.34 11.39 38.18 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.299 -0.876 . . . . 0.0 109.974 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.528 ' HA3' ' CA ' ' A' ' 84' ' ' LEU . . . -102.2 29.69 11.96 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 72.6 153.32 0.13 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.391 -1.064 . . . . 0.0 110.43 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.78 -8.71 22.88 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.367 -0.833 . . . . 0.0 110.378 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.417 ' O ' ' HB2' ' A' ' 94' ' ' GLN . 10.4 mmp_? -70.96 -45.07 64.75 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.284 -0.885 . . . . 0.0 109.842 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.537 HG13 ' N ' ' A' ' 85' ' ' ILE . 91.0 t -52.45 -47.09 47.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 O-C-N 121.409 -0.807 . . . . 0.0 109.898 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.8 t -64.55 -36.78 85.34 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.215 -0.928 . . . . 0.0 109.92 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 56.3 mm-40 -58.08 -46.65 85.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.248 -0.908 . . . . 0.0 109.844 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.446 ' HB3' ' SD ' ' A' ' 57' ' ' MET . 0.1 OUTLIER -60.25 -39.82 88.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.835 . . . . 0.0 109.59 179.415 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 51.5 t -55.02 -40.82 70.59 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.364 -0.835 . . . . 0.0 109.564 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -29.58 64.75 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.48 -0.763 . . . . 0.0 109.669 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 0.5 OUTLIER -81.83 -12.52 58.46 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.479 -0.763 . . . . 0.0 110.006 179.788 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.419 ' OD1' ' O ' ' A' ' 98' ' ' GLU . 70.4 m-20 -137.15 42.18 2.42 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.309 -0.869 . . . . 0.0 110.047 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -35.67 75.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.272 -0.893 . . . . 0.0 110.237 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.456 ' O ' ' HB ' ' A' ' 105' ' ' THR . 25.4 m-85 -60.97 -25.88 67.16 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.387 -0.821 . . . . 0.0 110.145 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.504 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -74.54 -40.82 61.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.332 -0.855 . . . . 0.0 110.159 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.431 HG13 HG23 ' A' ' 131' ' ' VAL . 3.0 t -74.57 -26.52 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.337 -0.852 . . . . 0.0 110.049 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -88.59 -24.02 22.96 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.303 -0.873 . . . . 0.0 110.405 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.504 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 14.0 t -61.79 -23.75 66.41 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.129 -0.982 . . . . 0.0 110.147 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.626 ' CD1' HD21 ' A' ' 64' ' ' LEU . 10.6 mt -70.44 -40.44 73.76 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 110.085 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.44 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 110.349 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.6 p . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 121.468 0.651 . . . . 0.0 110.03 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 6.5 t30 -43.29 -45.7 6.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.379 -0.825 . . . . 0.0 110.344 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.538 ' CG1' HG12 ' A' ' 74' ' ' VAL . 1.2 t -82.2 -37.25 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.196 -0.94 . . . . 0.0 110.059 -179.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.44 ' HG3' ' HA ' ' A' ' 107' ' ' LYS . 31.1 ttp180 -53.6 -61.5 2.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.08 -1.012 . . . . 0.0 110.837 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 78.9 mt-10 -65.76 -40.65 92.28 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.351 -0.843 . . . . 0.0 111.259 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 11.2 tptm -52.68 -51.06 61.89 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.073 -1.017 . . . . 0.0 110.203 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.474 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -58.73 -45.54 89.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.378 -0.826 . . . . 0.0 109.958 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.0 tttm -49.66 -46.41 49.68 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.264 -0.897 . . . . 0.0 109.917 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.64 -51.01 68.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.318 -0.864 . . . . 0.0 110.091 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.53 HD11 ' CD1' ' A' ' 85' ' ' ILE . 20.5 tp -47.61 -30.69 3.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.214 -0.929 . . . . 0.0 110.04 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.431 HG23 HG13 ' A' ' 103' ' ' VAL . 28.2 t -81.52 -34.76 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.332 -0.855 . . . . 0.0 110.287 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . 0.438 ' O ' ' N ' ' A' ' 134' ' ' LEU . . . -71.52 -60.36 2.27 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.324 -0.86 . . . . 0.0 110.539 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 132' ' ' ALA . 0.8 OUTLIER -42.1 -26.77 0.11 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 110.387 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.575 HD11 HG23 ' A' ' 85' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 O-C-N 121.279 -0.888 . . . . 0.0 110.211 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.215 0.531 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.549 ' HB1' HD11 ' A' ' 46' ' ' LEU . . . -68.55 -41.04 80.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.272 -0.893 . . . . 0.0 110.191 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.451 ' HG3' HG13 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -55.11 -25.86 34.35 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.281 -0.887 . . . . 0.0 110.248 -180.0 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.452 HD11 HG21 ' A' ' 22' ' ' ILE . 40.8 mt -80.47 -44.9 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.258 -0.901 . . . . 0.0 110.273 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.509 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 2.1 mtmm -62.75 -32.18 73.26 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.238 -0.914 . . . . 0.0 110.122 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.54 HG23 HG21 ' A' ' 56' ' ' ILE . 33.1 t -71.24 -41.32 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.309 -0.869 . . . . 0.0 110.11 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -56.9 -42.49 79.99 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 110.027 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -72.97 -38.15 66.81 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.376 -0.827 . . . . 0.0 110.056 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.51 ' CB ' ' CD2' ' A' ' 39' ' ' LEU . . . -63.96 -22.16 66.8 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.304 -0.873 . . . . 0.0 110.094 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.484 ' CG2' ' HA ' ' A' ' 77' ' ' ALA . 13.2 p . . . . . 0 N--CA 1.491 1.613 0 O-C-N 121.259 -0.901 . . . . 0.0 110.17 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.51 ' CD2' ' CB ' ' A' ' 27' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.338 0.589 . . . . 0.0 110.215 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 4.2 mmt -86.88 -47.64 8.84 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 110.201 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.507 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 7.2 t -57.87 -19.78 31.88 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.266 -0.896 . . . . 0.0 110.143 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.414 ' OE2' ' HD3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -82.0 -58.13 3.1 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.237 -0.915 . . . . 0.0 110.192 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.525 ' CD1' HD11 ' A' ' 80' ' ' LEU . 96.4 mt -50.41 -35.56 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.163 -0.961 . . . . 0.0 109.937 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.538 ' HB3' HD23 ' A' ' 84' ' ' LEU . . . -67.32 -54.27 22.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.317 -0.864 . . . . 0.0 109.509 179.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.1 -21.88 3.65 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.159 -0.963 . . . . 0.0 108.988 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.549 HD11 ' HB1' ' A' ' 20' ' ' ALA . 14.1 mt -81.73 -37.83 26.68 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.574 -0.704 . . . . 0.0 109.927 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.543 HG21 HG23 ' A' ' 92' ' ' VAL . 80.6 p -49.77 -40.91 42.83 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.071 -1.018 . . . . 0.0 109.243 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.587 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 72.4 m-85 -44.39 -47.09 9.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.233 -0.917 . . . . 0.0 109.317 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.547 ' O ' ' C ' ' A' ' 50' ' ' VAL . 2.8 m120 -70.14 90.71 0.67 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.707 -0.621 . . . . 0.0 110.432 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.547 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.58 -58.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.269 178.099 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.547 HG13 ' N ' ' A' ' 52' ' ' ALA . 2.6 t -61.75 -64.4 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.096 -1.002 . . . . 0.0 109.943 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.547 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -37.89 -45.24 0.84 Allowed 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.759 -177.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.586 ' CE1' ' HA ' ' A' ' 92' ' ' VAL . 20.6 t80 -60.99 -53.95 50.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.292 -0.88 . . . . 0.0 110.166 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.52 -30.29 40.82 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.291 -0.88 . . . . 0.0 109.946 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -80.15 -29.38 38.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.428 -0.795 . . . . 0.0 110.01 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.54 HG21 HG23 ' A' ' 24' ' ' VAL . 10.3 mt -77.79 -69.63 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.356 -0.84 . . . . 0.0 110.09 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.507 ' CE ' ' HG3' ' A' ' 95' ' ' GLN . 0.2 OUTLIER -45.96 -35.45 4.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.27 -0.894 . . . . 0.0 110.111 179.732 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.5 t -58.36 -66.09 0.54 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.279 -0.888 . . . . 0.0 110.197 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.09 -17.24 16.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.301 -0.875 . . . . 0.0 109.986 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.545 HG21 HD11 ' A' ' 64' ' ' LEU . 0.7 OUTLIER -79.12 -33.15 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.37 -0.831 . . . . 0.0 109.813 179.809 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.551 ' CZ3' ' HE2' ' A' ' 81' ' ' MET . 12.2 m95 -75.74 -41.78 52.39 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.251 -0.905 . . . . 0.0 110.111 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.1 -57.7 11.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.306 -0.871 . . . . 0.0 110.13 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -66.88 -11.57 56.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 110.12 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.683 HD23 HD11 ' A' ' 106' ' ' LEU . 3.7 mt -80.32 -22.19 41.75 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.197 -0.94 . . . . 0.0 110.265 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.9 t30 . . . . . 0 C--N 1.304 -1.377 0 O-C-N 121.243 -0.911 . . . . 0.0 109.966 -179.979 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.46 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 64.9 p-90 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.283 0.563 . . . . 0.0 110.238 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -43.98 -49.84 8.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.257 -0.902 . . . . 0.0 110.108 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -54.08 -49.1 69.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 110.2 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.581 ' CG1' ' CG2' ' A' ' 123' ' ' VAL . 25.0 t -49.48 -49.95 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.325 -0.86 . . . . 0.0 110.278 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.62 ' CE1' ' CD ' ' A' ' 126' ' ' LYS . 6.7 t80 -47.08 -55.25 8.65 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.284 -0.885 . . . . 0.0 110.586 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.447 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -66.88 -23.86 66.05 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.107 -0.996 . . . . 0.0 110.513 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.533 ' HB3' HD22 ' A' ' 64' ' ' LEU . . . -68.89 -68.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.234 -0.916 . . . . 0.0 110.378 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.53 ' HE2' HG12 ' A' ' 74' ' ' VAL . 0.3 OUTLIER -49.63 -31.96 11.93 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.381 -0.824 . . . . 0.0 110.192 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.7 m -55.27 -56.3 21.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.14 -0.975 . . . . 0.0 109.646 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.529 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 29.7 tp -51.6 -66.62 0.35 Allowed 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.329 -0.857 . . . . 0.0 108.818 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.551 ' HE2' ' CZ3' ' A' ' 61' ' ' TRP . 47.3 ttm -41.32 -28.49 0.11 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.444 -0.785 . . . . 0.0 110.418 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.513 ' N ' HD11 ' A' ' 130' ' ' LEU . 0.2 OUTLIER -72.3 -47.08 52.71 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.21 -0.931 . . . . 0.0 110.529 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.572 ' CE1' HG22 ' A' ' 87' ' ' THR . 33.6 t80 -70.54 -30.53 67.29 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.236 -0.915 . . . . 0.0 111.355 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.538 HD23 ' HB3' ' A' ' 44' ' ' ALA . 6.7 mt -75.26 -33.29 61.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.941 -1.1 . . . . 0.0 110.521 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.522 ' CD1' HD23 ' A' ' 130' ' ' LEU . 53.7 mt -62.15 -29.76 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 120.995 -1.065 . . . . 0.0 110.352 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.7 tttt -85.89 -71.13 0.55 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.245 -0.909 . . . . 0.0 110.541 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.572 HG22 ' CE1' ' A' ' 83' ' ' TYR . 11.0 t -94.34 -20.43 19.76 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.198 -0.938 . . . . 0.0 110.446 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.587 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -49.32 -66.4 2.25 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 3.5 t 171.98 158.21 0.09 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.099 -1.236 . . . . 0.0 110.256 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -63.46 -12.91 35.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.293 -0.879 . . . . 0.0 110.263 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.452 ' HD3' ' O ' ' A' ' 47' ' ' THR . 3.9 ptm85 -84.67 -29.18 25.86 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -0.903 . . . . 0.0 110.237 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.586 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 59.9 t -67.65 -31.46 52.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.194 -0.941 . . . . 0.0 109.818 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 83.7 p -80.0 -39.19 30.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.324 -0.86 . . . . 0.0 109.712 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -61.58 -51.23 69.41 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.309 -0.87 . . . . 0.0 109.773 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.507 ' HG3' ' CE ' ' A' ' 57' ' ' MET . 5.3 tp-100 -57.67 -40.1 78.58 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.455 -0.778 . . . . 0.0 109.536 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 8.5 t -55.62 -37.87 68.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -0.873 . . . . 0.0 109.54 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.93 -32.61 67.5 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.437 -0.789 . . . . 0.0 109.705 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -71.16 -24.09 62.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.443 -0.786 . . . . 0.0 109.801 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.76 36.04 4.71 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.44 -0.788 . . . . 0.0 110.106 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.438 ' O ' HG12 ' A' ' 103' ' ' VAL . 0.3 OUTLIER -59.69 -20.67 57.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.333 -0.854 . . . . 0.0 110.271 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.437 ' O ' ' HB ' ' A' ' 105' ' ' THR . 55.1 m-85 -76.24 -28.46 57.16 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.193 -0.942 . . . . 0.0 110.227 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.54 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -76.71 -39.03 53.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 110.222 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.579 ' CG1' ' N ' ' A' ' 104' ' ' GLN . 3.2 p -74.71 -42.03 47.75 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 CA-C-O 121.942 0.877 . . . . 0.0 109.08 179.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.579 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 14.3 mm100 -70.04 -21.78 63.15 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.556 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.54 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 4.7 t -57.47 -16.08 8.64 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.986 -1.072 . . . . 0.0 109.994 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.683 HD11 HD23 ' A' ' 64' ' ' LEU . 76.4 mt -74.99 -37.42 61.87 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.263 -0.898 . . . . 0.0 110.382 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 104' ' ' GLN . 2.8 pttp . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.223 -0.923 . . . . 0.0 110.136 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.557 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.4 p . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.64 0.733 . . . . 0.0 109.954 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.557 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 37.8 m-80 -47.77 -60.32 2.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.434 -0.791 . . . . 0.0 110.282 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.581 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 14.9 p -72.46 -13.09 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.245 -0.909 . . . . 0.0 110.494 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.473 ' HB3' ' O ' ' A' ' 121' ' ' VAL . 6.4 ttt180 -74.25 -69.02 0.47 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.14 -0.975 . . . . 0.0 110.563 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.46 -34.92 71.39 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.327 -0.858 . . . . 0.0 110.644 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.62 ' CD ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -58.31 -56.56 20.51 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.036 -1.04 . . . . 0.0 109.885 179.978 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.454 ' HB2' ' HE3' ' A' ' 78' ' ' MET . . . -54.5 -44.88 73.1 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 109.93 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 11.2 mtpt -57.29 -35.13 69.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.272 -0.893 . . . . 0.0 110.244 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -59.44 -48.29 82.22 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.295 -0.878 . . . . 0.0 110.422 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.522 HD23 ' CD1' ' A' ' 85' ' ' ILE . 3.8 tt -55.19 -51.63 65.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.197 -0.939 . . . . 0.0 110.264 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.484 ' CG2' ' CG1' ' A' ' 103' ' ' VAL . 96.0 t -63.75 -26.89 41.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.423 -0.798 . . . . 0.0 110.387 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.97 -47.03 79.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.278 -0.889 . . . . 0.0 110.186 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 mt -58.01 -48.87 78.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.265 -0.897 . . . . 0.0 110.406 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.476 HD12 ' CG2' ' A' ' 85' ' ' ILE . 9.6 mp . . . . . 0 N--CA 1.493 1.676 0 O-C-N 121.218 -0.926 . . . . 0.0 110.383 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.298 0.57 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.521 ' HB3' ' CD1' ' A' ' 46' ' ' LEU . . . -54.16 -46.12 72.23 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 110.115 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.444 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 3.1 pt-20 -41.87 -46.73 4.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.387 -0.821 . . . . 0.0 110.418 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.3 mt -63.13 -44.21 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.223 -0.923 . . . . 0.0 110.023 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.527 ' CG ' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -57.22 -32.74 66.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.289 -0.882 . . . . 0.0 110.103 179.775 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.527 ' CG1' ' HB3' ' A' ' 59' ' ' MET . 28.2 t -71.72 -28.06 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.148 -0.97 . . . . 0.0 110.018 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -45.32 64.04 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.204 -0.935 . . . . 0.0 109.985 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -78.54 -22.53 47.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.328 -0.857 . . . . 0.0 110.022 179.85 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.437 ' N ' HD13 ' A' ' 39' ' ' LEU . . . -77.26 -21.98 52.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.294 -0.879 . . . . 0.0 110.218 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.452 HG21 ' HA ' ' A' ' 77' ' ' ALA . 25.2 p . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.225 -0.922 . . . . 0.0 110.199 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.527 HD22 ' CG ' ' A' ' 23' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.22 0.533 . . . . 0.0 110.137 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.564 ' HG2' ' CG ' ' A' ' 83' ' ' TYR . 0.2 OUTLIER -77.97 -56.52 4.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.235 -0.915 . . . . 0.0 110.182 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.7 t -62.73 -29.89 71.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.271 -0.893 . . . . 0.0 110.386 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.47 -60.46 2.3 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.168 -0.957 . . . . 0.0 110.467 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.486 HG22 HD13 ' A' ' 43' ' ' ILE . 15.8 mt -50.39 -31.65 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.222 -0.924 . . . . 0.0 110.301 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.561 ' HB1' HD22 ' A' ' 84' ' ' LEU . . . -70.66 -51.31 28.69 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.071 -1.018 . . . . 0.0 109.418 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.468 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.5 OUTLIER -53.96 -20.6 6.43 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.102 -0.999 . . . . 0.0 108.892 178.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.521 ' CD1' ' HB3' ' A' ' 20' ' ' ALA . 20.4 mt -81.13 -37.02 29.54 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.535 -0.728 . . . . 0.0 109.954 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.549 HG22 HG21 ' A' ' 92' ' ' VAL . 80.7 p -53.04 -42.87 66.14 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.099 -1.001 . . . . 0.0 109.099 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 93.1 m-85 -44.37 -42.22 6.71 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.267 -0.896 . . . . 0.0 109.511 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.532 ' O ' ' N ' ' A' ' 51' ' ' VAL . 5.3 m-80 -73.19 92.64 1.76 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.483 -0.761 . . . . 0.0 110.187 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.526 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.39 -57.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.657 178.343 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.565 HG13 ' N ' ' A' ' 52' ' ' ALA . 3.0 t -65.82 -66.38 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.963 -1.086 . . . . 0.0 110.482 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.565 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -36.01 -45.31 0.42 Allowed 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.161 0.505 . . . . 0.0 111.08 -177.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.586 ' CE1' HG23 ' A' ' 92' ' ' VAL . 6.0 t80 -55.68 -58.85 6.08 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.307 -0.871 . . . . 0.0 110.393 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.458 ' O ' ' HB2' ' A' ' 58' ' ' SER . 18.2 m -51.1 -42.03 60.38 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.165 -0.959 . . . . 0.0 110.44 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.444 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 1.5 mm-40 -66.33 -30.96 71.48 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.198 -0.939 . . . . 0.0 110.505 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.518 HG21 HD13 ' A' ' 84' ' ' LEU . 7.1 mt -74.23 -70.01 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.334 -0.854 . . . . 0.0 110.359 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.424 ' HE1' ' CZ2' ' A' ' 61' ' ' TRP . 52.6 mmm -46.7 -38.27 9.62 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.131 -0.981 . . . . 0.0 110.128 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.458 ' HB2' ' O ' ' A' ' 54' ' ' SER . 23.2 t -52.7 -60.68 2.96 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.252 -0.905 . . . . 0.0 110.26 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.527 ' HB3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -58.23 -31.47 67.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.142 -0.974 . . . . 0.0 109.858 179.793 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.561 HG22 HD13 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -66.92 -29.59 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.411 -0.806 . . . . 0.0 109.917 179.883 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.572 ' CZ3' ' HE2' ' A' ' 81' ' ' MET . 19.7 m95 -79.39 -41.67 27.22 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.247 -0.908 . . . . 0.0 110.434 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.53 -66.3 0.46 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.249 -0.907 . . . . 0.0 110.636 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.521 ' CZ ' ' HB3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -61.37 -23.9 66.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.916 . . . . 0.0 110.606 -179.602 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.704 HD21 HD11 ' A' ' 106' ' ' LEU . 3.8 mt -60.78 -27.34 67.92 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.151 -0.968 . . . . 0.0 110.337 -179.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.5 t30 . . . . . 0 C--N 1.303 -1.432 0 O-C-N 121.286 -0.883 . . . . 0.0 110.014 179.96 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 33.1 p-90 . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.281 0.562 . . . . 0.0 110.272 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -45.92 -46.76 16.24 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.298 -0.876 . . . . 0.0 110.285 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -59.81 -40.01 86.98 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.234 -0.916 . . . . 0.0 110.258 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.545 HG11 ' CG1' ' A' ' 123' ' ' VAL . 49.6 t -62.02 -57.32 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.172 -0.955 . . . . 0.0 110.272 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 74' ' ' VAL . 4.6 t80 -42.38 -54.54 3.76 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.299 -0.875 . . . . 0.0 110.315 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -36.69 80.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.19 -0.944 . . . . 0.0 110.263 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.535 ' HB3' HD23 ' A' ' 64' ' ' LEU . . . -62.41 -25.87 68.18 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.235 -0.916 . . . . 0.0 110.159 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.531 ' HE2' ' CG1' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -78.57 -35.32 46.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.198 -0.939 . . . . 0.0 110.177 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 25.6 m -60.26 -55.26 35.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 0.0 109.997 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.531 ' CD2' HD13 ' A' ' 60' ' ' ILE . 25.5 tp -59.91 -34.63 73.46 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.456 -0.778 . . . . 0.0 109.964 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.572 ' HE2' ' CZ3' ' A' ' 61' ' ' TRP . 15.9 ttm -66.39 -33.74 76.4 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.137 -0.977 . . . . 0.0 110.122 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.526 ' HB2' ' CD1' ' A' ' 130' ' ' LEU . 3.7 tp10 -77.74 -63.83 1.29 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.295 -0.878 . . . . 0.0 110.144 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.564 ' CG ' ' HG2' ' A' ' 40' ' ' MET . 54.0 t80 -41.27 -49.65 3.66 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.418 -0.801 . . . . 0.0 110.641 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.561 HD22 ' HB1' ' A' ' 44' ' ' ALA . 81.6 mt -64.72 -43.78 92.32 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.311 -0.868 . . . . 0.0 110.337 -179.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.526 HG21 HD12 ' A' ' 134' ' ' LEU . 13.5 mt -49.69 -25.98 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.086 -1.009 . . . . 0.0 109.768 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.8 mttp -97.18 -81.36 0.43 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 110.053 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.556 HG21 ' CE1' ' A' ' 83' ' ' TYR . 13.0 t -72.64 -24.67 61.08 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.301 -0.874 . . . . 0.0 110.271 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.497 ' N ' HG23 ' A' ' 87' ' ' THR . . . -47.22 -77.23 0.11 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.435 ' HB3' HG22 ' A' ' 92' ' ' VAL . 26.7 t -179.17 155.98 0.75 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.159 -1.2 . . . . 0.0 110.326 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -56.91 -17.79 10.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.288 -0.882 . . . . 0.0 110.177 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -83.25 -37.07 24.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.323 -0.86 . . . . 0.0 110.175 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.586 HG23 ' CE1' ' A' ' 53' ' ' PHE . 59.2 t -59.92 -32.14 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.292 -0.88 . . . . 0.0 110.085 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.0 t -79.01 -40.75 30.63 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.0 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.527 ' O ' ' CG ' ' A' ' 97' ' ' LYS . 38.9 mt-30 -65.58 -26.14 67.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 109.867 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.41 ' HG2' ' HE2' ' A' ' 57' ' ' MET . 0.0 OUTLIER -75.41 -35.91 60.91 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.244 -0.91 . . . . 0.0 109.519 179.588 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . 0.461 ' SG ' ' CD1' ' A' ' 85' ' ' ILE . 1.3 m -65.61 -37.9 87.92 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.33 -0.856 . . . . 0.0 109.669 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.527 ' CG ' ' O ' ' A' ' 94' ' ' GLN . 0.2 OUTLIER -72.8 -28.14 62.4 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.339 -0.851 . . . . 0.0 109.596 179.349 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.496 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 7.7 mm-40 -75.32 -29.99 60.17 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.368 -0.832 . . . . 0.0 109.348 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -116.66 44.38 2.04 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.502 -0.749 . . . . 0.0 109.583 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -29.27 69.78 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.431 -0.793 . . . . 0.0 110.259 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.473 ' O ' ' HB ' ' A' ' 105' ' ' THR . 57.9 m-85 -66.44 -24.92 66.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.205 -0.934 . . . . 0.0 109.779 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.524 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -77.47 -41.32 39.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.462 -0.774 . . . . 0.0 110.112 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.425 HG21 ' CZ3' ' A' ' 61' ' ' TRP . 4.0 t -72.33 -31.01 37.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.356 -0.84 . . . . 0.0 110.156 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.497 ' O ' ' CG ' ' A' ' 107' ' ' LYS . 7.5 mm-40 -86.91 -19.41 28.89 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 110.426 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.524 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 6.6 t -54.7 -18.9 5.17 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.931 . . . . 0.0 109.927 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.704 HD11 HD21 ' A' ' 64' ' ' LEU . 91.3 mt -79.41 -35.65 40.31 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.389 -0.819 . . . . 0.0 110.118 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.533 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.263 -0.898 . . . . 0.0 110.32 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.558 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.3 p . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 121.388 0.613 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . 0.558 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 6.0 t30 -39.19 -31.77 0.08 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.66 -0.65 . . . . 0.0 110.361 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.545 ' CG1' HG11 ' A' ' 74' ' ' VAL . 2.3 t -83.49 -52.62 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.304 -0.872 . . . . 0.0 109.93 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.533 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 4.4 mtp180 -44.79 -43.67 8.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.142 -0.974 . . . . 0.0 111.176 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -79.33 -46.15 18.25 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.195 -0.94 . . . . 0.0 111.769 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . 0.522 ' CD ' ' HB2' ' A' ' 78' ' ' MET . 0.0 OUTLIER -53.66 -54.92 30.88 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.919 -1.113 . . . . 0.0 110.109 -179.511 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.488 ' CB ' ' SD ' ' A' ' 78' ' ' MET . . . -55.46 -44.22 76.21 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.437 -0.789 . . . . 0.0 110.396 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -58.85 -34.66 71.83 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.168 -0.958 . . . . 0.0 110.5 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -69.41 -53.54 18.85 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.227 -0.921 . . . . 0.0 110.78 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.526 ' CD1' ' HB2' ' A' ' 82' ' ' GLU . 3.3 tt -47.35 -33.66 6.06 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.09 -1.006 . . . . 0.0 110.416 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.455 HG21 ' O ' ' A' ' 127' ' ' ALA . 44.8 t -77.26 -35.38 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.252 -0.905 . . . . 0.0 110.333 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.19 -49.53 75.7 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -0.91 . . . . 0.0 110.694 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.1 mt -60.93 -56.83 16.52 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.157 -0.965 . . . . 0.0 110.467 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.526 HD12 HG21 ' A' ' 85' ' ' ILE . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.18 -0.95 . . . . 0.0 110.284 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.61 -61.1 1.02 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.204 -1.174 . . . . 0.0 110.219 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 19.6 t -103.76 -28.14 11.83 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.263 -0.898 . . . . 0.0 110.196 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -105.74 173.62 6.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.253 -0.904 . . . . 0.0 110.171 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.66 116.66 18.38 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.162 -0.962 . . . . 0.0 110.291 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.38 132.12 20.4 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.275 -0.891 . . . . 0.0 110.104 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 55.0 m -111.64 -50.25 2.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -0.911 . . . . 0.0 110.309 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.89 105.75 0.34 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.211 -0.93 . . . . 0.0 110.272 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 6' ' ' LEU . 1.3 m -59.1 -64.06 1.08 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.274 -0.891 . . . . 0.0 110.199 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.433 ' CB ' ' O ' ' A' ' 5' ' ' SER . 0.6 OUTLIER 64.83 149.7 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.217 -0.927 . . . . 0.0 110.223 179.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.82 -83.75 0.65 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.216 -0.928 . . . . 0.0 110.182 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.09 157.93 44.85 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -112.48 167.96 10.03 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.266 -0.896 . . . . 0.0 110.22 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 8.5 mmm -80.79 -157.06 0.15 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.249 -0.907 . . . . 0.0 110.166 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.79 -152.41 0.05 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.192 -0.942 . . . . 0.0 110.185 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.99 -170.49 1.97 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.216 -0.927 . . . . 0.0 110.286 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.2 mm -67.87 134.98 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.301 -0.875 . . . . 0.0 110.194 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.9 t -75.38 116.89 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.206 -0.934 . . . . 0.0 110.221 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 20.6 p-80 -63.75 -13.3 42.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.265 -0.897 . . . . 0.0 110.176 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -101.13 77.93 1.86 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 110.209 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -45.76 109.1 0.15 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.255 -0.903 . . . . 0.0 110.117 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.19 66.32 1.34 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.259 -0.901 . . . . 0.0 110.249 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -122.23 19.38 10.67 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.193 -0.942 . . . . 0.0 110.222 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.458 ' HB2' ' HB2' ' A' ' 52' ' ' ALA . . . -68.37 -52.31 34.57 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.237 -0.914 . . . . 0.0 110.309 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' HD13 ' A' ' 22' ' ' ILE . 0.2 OUTLIER -41.05 -34.03 0.39 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.287 -0.883 . . . . 0.0 110.601 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.469 HD13 ' OE1' ' A' ' 21' ' ' GLU . 20.1 mm -77.88 -41.86 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.095 -1.003 . . . . 0.0 109.964 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.512 ' CE ' ' HG3' ' A' ' 42' ' ' GLU . 13.3 tptt -61.55 -58.65 7.26 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.253 -0.904 . . . . 0.0 109.934 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.528 ' CG2' HG21 ' A' ' 56' ' ' ILE . 53.7 t -45.45 -55.11 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.407 -0.808 . . . . 0.0 110.385 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -52.69 -63.36 1.17 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.913 . . . . 0.0 110.653 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -14.05 5.44 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.401 -0.812 . . . . 0.0 110.714 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.536 ' CB ' HD21 ' A' ' 39' ' ' LEU . . . -86.55 -33.44 20.25 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.134 -0.979 . . . . 0.0 110.328 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.523 ' CA ' ' HB3' ' A' ' 76' ' ' LYS . 19.8 p -91.61 18.74 7.06 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.288 -0.883 . . . . 0.0 110.119 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.453 ' HB2' ' O ' ' A' ' 28' ' ' THR . 20.3 t 178.28 105.68 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.3 -0.875 . . . . 0.0 110.159 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.407 ' O ' ' C ' ' A' ' 31' ' ' ASP . 2.2 t-20 -109.07 37.39 2.58 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.269 -0.894 . . . . 0.0 110.19 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.584 ' CB ' ' CD ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER -44.26 -60.93 2.37 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.2 -0.938 . . . . 0.0 110.224 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.584 ' CD ' ' CB ' ' A' ' 31' ' ' ASP . 24.2 Cg_endo -68.27 -162.9 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.684 0 O-C-N 123.911 1.48 . . . . 0.0 110.301 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 2.4 m95 -112.41 -164.43 0.92 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.227 -0.921 . . . . 0.0 110.6 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 141.03 -167.3 25.72 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -63.81 144.03 87.64 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 O-C-N 124.011 1.532 . . . . 0.0 110.272 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.6 t -129.37 60.86 1.55 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.912 . . . . 0.0 110.344 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -101.74 -71.54 0.71 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.141 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.445 ' HB3' ' HB3' ' A' ' 41' ' ' SER . 0.2 OUTLIER -163.65 67.31 0.18 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.191 -0.943 . . . . 0.0 110.241 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.536 HD21 ' CB ' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -57.33 -43.87 83.72 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.224 -0.922 . . . . 0.0 110.231 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.439 ' HA ' HD11 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -55.18 -45.02 75.76 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.131 -0.98 . . . . 0.0 110.141 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.451 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 15.6 t -59.72 -29.59 68.22 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.331 -0.855 . . . . 0.0 110.272 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.512 ' HG3' ' CE ' ' A' ' 23' ' ' LYS . 22.0 mm-40 -70.43 -52.06 24.92 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.255 -0.903 . . . . 0.0 110.286 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.528 HG23 ' CD2' ' A' ' 84' ' ' LEU . 7.2 mt -54.24 -35.54 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.183 -0.948 . . . . 0.0 109.992 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.577 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -67.78 -52.21 39.81 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.31 -0.869 . . . . 0.0 109.486 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.448 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 10.8 t0 -53.91 -20.23 5.74 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.087 -1.008 . . . . 0.0 109.187 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 43' ' ' ILE . 8.5 mt -82.7 -38.11 23.83 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.523 -0.736 . . . . 0.0 110.093 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.51 HG22 HG21 ' A' ' 92' ' ' VAL . 72.3 p -51.82 -42.5 62.56 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.243 -0.911 . . . . 0.0 109.377 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.547 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 86.3 m-85 -43.63 -44.56 6.4 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.712 -0.795 . . . . 0.0 109.259 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.463 ' O ' ' O ' ' A' ' 48' ' ' TYR . 2.4 t-20 -56.68 -157.48 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.865 0.84 . . . . 0.0 110.298 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.6 t -125.97 -34.56 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -178.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.57 HG12 ' N ' ' A' ' 52' ' ' ALA . 11.2 t -84.54 -71.91 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 CA-C-O 121.967 0.889 . . . . 0.0 109.84 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.57 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -37.92 -40.79 0.49 Allowed 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.737 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.488 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 8.1 t80 -54.54 -56.4 19.33 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.425 -0.797 . . . . 0.0 110.214 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.45 ' O ' ' HB2' ' A' ' 58' ' ' SER . 3.5 m -58.87 -34.96 72.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.301 -0.874 . . . . 0.0 110.251 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.65 -20.02 60.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.279 -0.888 . . . . 0.0 110.04 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.528 HG21 ' CG2' ' A' ' 24' ' ' VAL . 36.6 mt -80.96 -70.07 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 110.135 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.5 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 70.5 mmm -52.01 -36.06 48.72 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.25 -0.906 . . . . 0.0 109.909 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 54' ' ' SER . 3.5 m -57.02 -62.69 1.57 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.308 -0.87 . . . . 0.0 110.147 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -25.32 61.06 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 109.894 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.541 HD12 ' CD2' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -72.86 -31.34 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.384 -0.823 . . . . 0.0 109.789 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.57 ' CH2' ' SD ' ' A' ' 81' ' ' MET . 14.9 m95 -72.9 -39.84 66.03 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.274 -0.892 . . . . 0.0 110.307 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -58.9 5.81 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.89 . . . . 0.0 110.211 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -63.58 -11.76 27.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.283 -0.885 . . . . 0.0 110.255 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.618 HD21 ' CD1' ' A' ' 106' ' ' LEU . 4.7 mt -80.17 -24.97 40.0 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.299 -0.876 . . . . 0.0 110.337 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.458 ' O ' ' O ' ' A' ' 66' ' ' ASP . 49.4 t-20 -111.31 42.44 1.67 Allowed 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.352 -0.842 . . . . 0.0 109.949 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.458 ' O ' ' O ' ' A' ' 65' ' ' ASN . 0.1 OUTLIER -52.4 -169.42 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.423 -0.798 . . . . 0.0 110.6 -179.756 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -86.44 -178.43 6.43 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.458 -0.776 . . . . 0.0 110.277 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -91.17 54.07 3.22 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -144.96 -37.15 0.29 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.374 -1.074 . . . . 0.0 110.293 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -135.68 79.78 1.8 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.233 -0.917 . . . . 0.0 110.303 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.467 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 69.3 p-90 -71.53 -2.95 18.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.311 -0.868 . . . . 0.0 110.178 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -48.21 -45.53 34.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.206 -0.934 . . . . 0.0 109.985 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.408 ' ND1' ' N ' ' A' ' 73' ' ' HIS . 2.8 m-70 -61.64 -36.57 81.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.311 -0.868 . . . . 0.0 109.924 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.58 ' CG1' ' CG2' ' A' ' 123' ' ' VAL . 16.4 t -63.1 -57.24 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.304 -0.873 . . . . 0.0 110.021 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.574 ' CE1' ' HD3' ' A' ' 126' ' ' LYS . 7.0 t80 -49.2 -49.11 44.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 109.928 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.523 ' HB3' ' CA ' ' A' ' 28' ' ' THR . 4.5 tptt -62.07 -31.85 72.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.339 -0.851 . . . . 0.0 109.843 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.539 ' HB2' HD23 ' A' ' 64' ' ' LEU . . . -69.96 -28.02 65.21 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.349 -0.844 . . . . 0.0 109.908 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.56 ' CE ' ' CG2' ' A' ' 123' ' ' VAL . 0.7 OUTLIER -73.34 -30.83 63.6 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.387 -0.82 . . . . 0.0 110.183 179.862 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.4 m -70.79 -36.66 73.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.214 -0.929 . . . . 0.0 109.97 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.541 ' CD2' HD12 ' A' ' 60' ' ' ILE . 42.0 tp -77.11 -31.4 55.8 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.318 -0.864 . . . . 0.0 109.677 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.57 ' SD ' ' CH2' ' A' ' 61' ' ' TRP . 31.0 ttp -76.71 -28.12 55.74 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.395 -0.815 . . . . 0.0 109.882 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.524 ' HB2' ' CD1' ' A' ' 130' ' ' LEU . 26.9 tt0 -85.33 -34.97 21.72 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.262 -0.899 . . . . 0.0 110.026 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.451 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 31.8 t80 -70.58 -45.34 65.57 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.309 -0.87 . . . . 0.0 110.257 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.577 HD23 ' HB2' ' A' ' 44' ' ' ALA . 50.7 mt -67.46 -40.41 85.36 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.274 -0.892 . . . . 0.0 110.16 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.529 ' N ' HG13 ' A' ' 92' ' ' VAL . 26.5 mt -56.75 -20.72 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 109.973 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 -82.4 0.41 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.24 -0.913 . . . . 0.0 110.013 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.449 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 7.6 t -76.6 -25.9 54.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.293 -0.879 . . . . 0.0 110.149 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.547 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -44.24 -69.58 0.69 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.424 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 176.61 176.16 0.31 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.224 -1.162 . . . . 0.0 110.215 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -79.12 -15.18 58.51 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 110.257 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 47' ' ' THR . 2.2 ptm180 -82.84 -28.59 30.02 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.132 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.529 HG13 ' N ' ' A' ' 85' ' ' ILE . 95.0 t -69.25 -31.18 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.198 -0.938 . . . . 0.0 109.628 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.453 ' OG ' HG22 ' A' ' 85' ' ' ILE . 74.5 m -78.81 -35.85 43.58 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.308 -0.87 . . . . 0.0 109.623 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.58 -41.11 98.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.381 -0.824 . . . . 0.0 109.714 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.21 -35.71 81.9 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.442 -0.786 . . . . 0.0 109.489 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.498 ' SG ' ' CD1' ' A' ' 134' ' ' LEU . 35.2 t -60.14 -39.8 87.6 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.436 -0.79 . . . . 0.0 109.676 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -33.09 69.24 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.437 -0.789 . . . . 0.0 109.776 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -78.15 -17.73 56.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.389 -0.819 . . . . 0.0 109.903 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -124.45 37.97 4.29 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.46 -0.775 . . . . 0.0 109.928 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -60.19 -29.06 68.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.307 -0.871 . . . . 0.0 110.192 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -64.89 -28.06 69.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.274 -0.892 . . . . 0.0 109.899 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.525 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -75.68 -42.79 50.21 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.378 -0.826 . . . . 0.0 110.042 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.5 HG13 ' CG2' ' A' ' 131' ' ' VAL . 3.3 t -71.75 -26.56 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.344 -0.847 . . . . 0.0 110.175 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.465 ' HG2' HG23 ' A' ' 131' ' ' VAL . 0.8 OUTLIER -85.31 -27.72 25.75 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.329 -0.857 . . . . 0.0 110.311 -179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.525 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 6.4 t -56.58 -17.0 7.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.313 -0.867 . . . . 0.0 110.037 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.618 ' CD1' HD21 ' A' ' 64' ' ' LEU . 17.4 mt -80.12 -40.73 26.87 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.286 -0.884 . . . . 0.0 110.097 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 124' ' ' ARG . 13.6 ttpt -50.49 -30.69 13.44 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.217 -0.927 . . . . 0.0 110.077 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -98.74 -19.23 17.58 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.314 -0.866 . . . . 0.0 110.197 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -59.02 90.24 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.288 -0.883 . . . . 0.0 110.145 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.45 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 9.1 pt20 -124.65 124.37 42.04 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.357 -0.839 . . . . 0.0 110.131 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -152.95 137.48 16.79 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.214 -0.929 . . . . 0.0 110.273 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.459 ' O ' ' HB2' ' A' ' 113' ' ' ASP . 47.7 t -138.48 40.76 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.076 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 112' ' ' VAL . 11.6 m-20 56.95 172.47 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.319 -0.863 . . . . 0.0 110.224 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -42.95 27.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.224 -0.923 . . . . 0.0 110.311 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -153.12 100.6 2.49 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.272 -0.893 . . . . 0.0 110.108 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -142.91 -149.51 5.14 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.45 ' O ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -111.88 149.75 31.41 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.273 -1.133 . . . . 0.0 110.195 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -81.26 84.66 6.54 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.273 -0.892 . . . . 0.0 110.233 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -118.24 17.26 13.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.261 -0.899 . . . . 0.0 110.212 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.453 ' O ' HG13 ' A' ' 123' ' ' VAL . . . -97.34 31.61 7.57 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.56 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.3 p -89.04 -44.83 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.244 -1.15 . . . . 0.0 110.169 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.56 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.9 OUTLIER -44.41 -37.17 3.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.367 -0.833 . . . . 0.0 109.9 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.58 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 8.5 p -79.75 -38.01 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.46 ' N ' ' CG1' ' A' ' 123' ' ' VAL . 5.1 ttp180 -54.9 -55.41 30.82 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.242 -0.911 . . . . 0.0 110.394 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -67.94 -28.68 67.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.411 -0.806 . . . . 0.0 110.529 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.574 ' HD3' ' CE1' ' A' ' 75' ' ' TYR . 2.3 tptt -60.51 -58.77 7.09 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.179 -0.951 . . . . 0.0 109.899 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.507 ' CB ' ' HB2' ' A' ' 106' ' ' LEU . . . -54.99 -42.67 72.77 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.395 -0.816 . . . . 0.0 110.099 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.67 -35.34 74.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.244 -0.91 . . . . 0.0 110.165 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -65.13 -52.64 54.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.3 -0.875 . . . . 0.0 110.464 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.524 ' CD1' ' HB2' ' A' ' 82' ' ' GLU . 0.1 OUTLIER -48.54 -39.56 23.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.218 -0.926 . . . . 0.0 110.443 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.5 ' CG2' HG13 ' A' ' 103' ' ' VAL . 11.8 t -77.32 -30.8 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.231 -0.918 . . . . 0.0 110.323 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.25 -56.67 12.98 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.204 -0.935 . . . . 0.0 110.172 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.4 mp -58.96 -53.12 61.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.263 -0.898 . . . . 0.0 110.31 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.516 ' CD1' ' O ' ' A' ' 130' ' ' LEU . 0.8 OUTLIER -55.27 -18.04 5.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.197 -0.939 . . . . 0.0 110.156 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -155.96 88.46 1.11 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.277 -0.89 . . . . 0.0 110.035 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -77.63 -52.15 9.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.219 -0.926 . . . . 0.0 110.521 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -120.93 150.95 40.29 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.193 -0.942 . . . . 0.0 110.343 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -122.71 146.69 47.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.301 -0.874 . . . . 0.0 110.02 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.455 ' O ' ' O ' ' A' ' 140' ' ' LEU . 7.3 mmm180 -93.87 69.91 3.99 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.243 -0.911 . . . . 0.0 110.494 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' A' ' 139' ' ' ARG . 0.1 OUTLIER 55.04 108.97 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.248 -0.908 . . . . 0.0 110.279 179.874 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.406 ' O ' ' HB2' ' A' ' 142' ' ' GLU . 5.9 ttt85 -69.67 -162.16 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.221 -0.924 . . . . 0.0 110.221 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 141' ' ' ARG . 7.2 tt0 -175.25 65.03 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.269 -0.895 . . . . 0.0 110.202 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.61 126.44 55.01 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.284 -0.885 . . . . 0.0 110.152 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.192 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 13.5 t -144.3 48.14 1.38 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.19 -1.183 . . . . 0.0 110.177 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 20.9 m -54.85 149.22 11.74 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.131 -0.98 . . . . 0.0 110.143 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -106.0 121.78 44.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.232 -0.917 . . . . 0.0 110.259 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -110.7 149.52 30.36 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.212 -0.93 . . . . 0.0 110.058 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.63 17.88 14.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.188 -0.945 . . . . 0.0 110.063 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.8 t -58.15 147.04 31.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.231 -0.918 . . . . 0.0 110.254 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.8 m -97.99 9.48 42.68 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.168 -0.957 . . . . 0.0 110.13 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.5 t 49.06 -141.98 0.6 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.298 -0.876 . . . . 0.0 110.185 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 mm? 53.97 24.01 4.36 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.29 -0.881 . . . . 0.0 110.228 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.433 ' O ' ' HD3' ' A' ' 8' ' ' ARG . 59.8 mtt180 -117.94 -171.92 2.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.278 -0.889 . . . . 0.0 110.272 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -152.3 -179.5 7.6 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.245 -0.909 . . . . 0.0 110.243 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.8 mm-40 -100.05 -45.67 5.59 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.242 -0.911 . . . . 0.0 110.23 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.425 ' C ' ' HG3' ' A' ' 11' ' ' LYS . 16.9 mtt -118.88 151.85 37.36 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.189 -0.944 . . . . 0.0 110.166 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HG3' ' C ' ' A' ' 10' ' ' MET . 1.8 mttt -135.49 -58.49 0.78 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.268 -0.895 . . . . 0.0 110.305 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -119.52 96.33 5.16 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.25 -0.907 . . . . 0.0 110.206 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 mp -78.64 137.21 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.229 -0.92 . . . . 0.0 110.138 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.4 p -93.63 158.03 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.253 -0.904 . . . . 0.0 110.341 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -73.94 -34.85 64.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.228 -0.92 . . . . 0.0 110.298 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.8 m-20 -126.94 95.75 4.41 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -0.954 . . . . 0.0 110.4 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.526 ' CD1' ' O ' ' A' ' 17' ' ' TYR . 15.1 p90 -55.97 145.85 24.06 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.314 -0.866 . . . . 0.0 110.108 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 14.5 m -96.16 7.68 45.79 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.163 -0.961 . . . . 0.0 110.257 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 18' ' ' SER . 6.1 mm-40 56.52 16.2 2.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.294 -0.879 . . . . 0.0 110.305 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.497 ' HA ' ' CD1' ' A' ' 46' ' ' LEU . . . -79.13 -48.74 13.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -0.884 . . . . 0.0 110.12 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.481 ' CG ' HG13 ' A' ' 22' ' ' ILE . 9.5 pt-20 -47.51 -32.31 5.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.342 -0.849 . . . . 0.0 110.241 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.481 HG13 ' CG ' ' A' ' 21' ' ' GLU . 28.8 mt -80.25 -43.6 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.258 -0.901 . . . . 0.0 110.172 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.472 ' O ' HD13 ' A' ' 43' ' ' ILE . 5.5 mmtm -57.64 -30.46 65.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.256 -0.902 . . . . 0.0 110.193 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.499 ' CG2' HG21 ' A' ' 56' ' ' ILE . 44.2 t -77.94 -46.92 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.242 -0.911 . . . . 0.0 110.119 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.85 -39.7 26.68 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.336 -0.852 . . . . 0.0 110.102 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -76.29 -37.96 56.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.398 -0.814 . . . . 0.0 110.121 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.518 ' CB ' HD23 ' A' ' 39' ' ' LEU . . . -65.49 -13.26 58.44 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.322 -0.861 . . . . 0.0 109.964 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.528 ' HA ' ' CB ' ' A' ' 76' ' ' LYS . 8.5 p -103.8 -28.42 11.64 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.284 -0.885 . . . . 0.0 110.188 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.5 m -76.16 -79.51 0.1 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.321 -0.862 . . . . 0.0 110.245 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -168.52 -179.05 3.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.22 -0.925 . . . . 0.0 110.163 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -153.8 146.32 17.44 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.279 -0.888 . . . . 0.0 110.369 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.577 ' O ' ' CE3' ' A' ' 33' ' ' TRP . 18.1 Cg_endo -65.32 -158.65 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 124.091 1.574 . . . . 0.0 110.254 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.577 ' CE3' ' O ' ' A' ' 32' ' ' PRO . 0.5 OUTLIER -144.4 -178.73 6.13 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.204 -0.935 . . . . 0.0 110.674 -179.916 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.61 -111.31 4.17 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -65.54 -165.0 0.07 OUTLIER 'Trans proline' 0 C--N 1.307 -1.64 0 O-C-N 123.862 1.454 . . . . 0.0 110.352 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.6 p -101.08 149.56 23.83 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.225 -0.922 . . . . 0.0 110.329 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -99.77 -28.9 12.92 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.251 -0.905 . . . . 0.0 110.323 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 53.51 63.63 2.14 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.143 -0.973 . . . . 0.0 110.283 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.518 HD23 ' CB ' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -119.39 -25.27 6.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.191 -0.943 . . . . 0.0 110.212 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.1 ttt -71.95 -60.54 2.18 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.29 -0.882 . . . . 0.0 110.18 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.459 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 82.7 p -53.84 -25.27 18.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.254 -0.904 . . . . 0.0 110.064 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -75.54 -53.17 9.05 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 110.114 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.525 ' CG2' HD13 ' A' ' 80' ' ' LEU . 59.3 mt -54.71 -35.3 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.297 -0.877 . . . . 0.0 110.134 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.544 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -71.75 -49.98 34.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.221 -0.924 . . . . 0.0 109.548 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -53.29 -21.13 5.03 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.059 -1.025 . . . . 0.0 108.827 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.526 ' O ' ' CB ' ' A' ' 52' ' ' ALA . 14.8 mt -79.25 -38.21 36.12 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.621 -0.674 . . . . 0.0 109.852 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.49 ' OG1' ' O ' ' A' ' 44' ' ' ALA . 72.7 p -51.91 -43.76 63.53 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.103 -0.998 . . . . 0.0 109.156 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.43 ' CE2' ' O ' ' A' ' 87' ' ' THR . 87.5 m-85 -44.67 -42.99 7.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.285 -0.884 . . . . 0.0 109.578 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.543 ' O ' ' C ' ' A' ' 50' ' ' VAL . 14.7 m-20 -72.96 90.65 1.49 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.469 -0.77 . . . . 0.0 110.348 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.543 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.2 -59.04 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.25 178.295 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.537 HG13 ' N ' ' A' ' 52' ' ' ALA . 2.6 t -62.98 -64.17 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.09 -1.006 . . . . 0.0 110.1 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.537 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -37.81 -47.48 1.02 Allowed 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 121.171 0.51 . . . . 0.0 110.846 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.552 ' CZ ' ' OE1' ' A' ' 95' ' ' GLN . 9.7 t80 -56.36 -54.28 47.4 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.292 -0.88 . . . . 0.0 110.289 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.06 -27.59 54.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.219 -0.926 . . . . 0.0 110.196 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -82.92 -25.31 32.54 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.301 -0.874 . . . . 0.0 110.208 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.519 HG23 HD13 ' A' ' 84' ' ' LEU . 8.7 mt -79.21 -69.96 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.361 -0.837 . . . . 0.0 109.945 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.535 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 52.0 mmm -45.85 -37.69 6.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.155 -0.966 . . . . 0.0 109.745 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.3 t -55.19 -61.44 2.33 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.347 -0.845 . . . . 0.0 109.893 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.413 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -59.21 -21.45 59.52 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.153 -0.967 . . . . 0.0 109.859 179.689 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.547 HG23 HD11 ' A' ' 64' ' ' LEU . 0.4 OUTLIER -76.24 -30.77 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.375 -0.828 . . . . 0.0 109.768 179.781 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 57' ' ' MET . 30.2 m95 -77.51 -51.0 11.45 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.891 . . . . 0.0 110.022 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.98 -51.77 49.41 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.241 -0.912 . . . . 0.0 109.969 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -69.01 -24.25 64.19 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.265 -0.897 . . . . 0.0 110.094 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.586 HD22 ' CD1' ' A' ' 106' ' ' LEU . 4.5 mt -71.07 -25.54 62.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.425 -0.797 . . . . 0.0 110.314 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.447 ' OD1' ' O ' ' A' ' 65' ' ' ASN . 18.1 t-20 -99.66 35.27 2.03 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.307 -0.871 . . . . 0.0 109.89 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -79.15 142.83 36.03 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.415 -0.803 . . . . 0.0 110.159 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.462 ' HB3' ' CZ ' ' A' ' 109' ' ' PHE . 19.0 p80 -161.23 164.3 30.47 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.598 -0.688 . . . . 0.0 110.181 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.59 -58.77 2.98 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.29 -88.56 0.09 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.351 -1.088 . . . . 0.0 110.097 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -146.57 143.1 28.63 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.225 -0.922 . . . . 0.0 110.16 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.446 ' CE3' ' HB2' ' A' ' 75' ' ' TYR . 51.7 p-90 -77.11 1.87 16.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.321 -0.862 . . . . 0.0 110.227 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' A' ' 71' ' ' TRP . 42.7 mtt-85 -43.18 -41.92 3.96 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.315 -0.866 . . . . 0.0 110.404 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.438 ' O ' ' HB2' ' A' ' 77' ' ' ALA . 31.1 m-70 -68.0 -43.84 77.97 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.107 -0.996 . . . . 0.0 110.248 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.549 HG12 ' HE2' ' A' ' 78' ' ' MET . 70.5 t -56.08 -51.49 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.253 -0.904 . . . . 0.0 110.297 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.446 ' HB2' ' CE3' ' A' ' 71' ' ' TRP . 6.1 t80 -49.78 -64.56 0.77 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.141 -0.974 . . . . 0.0 109.975 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.528 ' CB ' ' HA ' ' A' ' 28' ' ' THR . 1.1 mmpt? -55.21 -21.7 14.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.327 -0.858 . . . . 0.0 110.044 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.559 ' HB1' HD21 ' A' ' 64' ' ' LEU . . . -69.79 -37.97 76.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.182 -0.949 . . . . 0.0 110.186 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.549 ' HE2' HG12 ' A' ' 74' ' ' VAL . 2.8 mpp? -68.39 -41.67 80.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.361 -0.837 . . . . 0.0 110.195 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.6 m -58.41 -45.99 87.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -0.889 . . . . 0.0 110.399 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.528 HD21 ' CG1' ' A' ' 60' ' ' ILE . 18.2 tp -58.45 -60.27 4.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.268 -0.895 . . . . 0.0 109.926 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.476 ' HE2' ' CZ3' ' A' ' 61' ' ' TRP . 28.1 ttm -53.78 -21.97 8.45 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.204 -0.935 . . . . 0.0 110.101 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.523 ' CA ' HD11 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -79.89 -37.89 33.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.236 -0.915 . . . . 0.0 110.716 -179.751 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.617 ' CE1' ' CG2' ' A' ' 87' ' ' THR . 32.3 t80 -81.0 -22.66 39.25 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.238 -0.914 . . . . 0.0 110.784 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.544 HD23 ' HB2' ' A' ' 44' ' ' ALA . 48.2 mt -85.17 -21.44 29.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.206 -0.934 . . . . 0.0 110.075 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.56 ' N ' HG12 ' A' ' 92' ' ' VAL . 33.2 mt -76.64 -13.98 14.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.316 -0.865 . . . . 0.0 109.553 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -105.39 -48.02 3.8 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.382 -0.824 . . . . 0.0 110.044 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.617 ' CG2' ' CE1' ' A' ' 83' ' ' TYR . 7.6 t -114.48 -2.72 13.12 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.272 -0.892 . . . . 0.0 110.168 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.548 ' O ' ' CB ' ' A' ' 89' ' ' SER . . . -89.88 34.88 3.92 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.548 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 2.5 t 74.28 150.14 0.11 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.447 -1.031 . . . . 0.0 110.157 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -65.18 -7.93 14.92 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.354 -0.841 . . . . 0.0 110.598 -179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -72.1 -38.47 69.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.111 -0.993 . . . . 0.0 109.732 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.56 HG12 ' N ' ' A' ' 85' ' ' ILE . 84.0 t -60.08 -28.92 42.52 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.372 -0.83 . . . . 0.0 109.937 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.486 ' CB ' HG22 ' A' ' 85' ' ' ILE . 10.3 p -83.57 -38.92 21.03 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.283 -0.886 . . . . 0.0 109.982 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -58.03 -57.89 10.83 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.228 -0.92 . . . . 0.0 109.694 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.552 ' OE1' ' CZ ' ' A' ' 53' ' ' PHE . 34.8 tt0 -52.79 -35.7 57.09 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.454 -0.778 . . . . 0.0 109.448 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 1.7 t -55.41 -44.23 76.01 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 109.563 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -66.0 -46.81 76.65 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.497 -0.752 . . . . 0.0 109.747 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -65.01 -16.12 63.08 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.408 -0.807 . . . . 0.0 109.797 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.5 32.81 4.95 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.366 -0.834 . . . . 0.0 109.844 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.1 mtp -61.63 -28.26 69.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.298 -0.876 . . . . 0.0 110.224 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.467 ' O ' ' HB ' ' A' ' 105' ' ' THR . 15.6 m-85 -66.84 -24.97 66.21 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.236 -0.915 . . . . 0.0 109.934 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.528 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -76.59 -40.88 48.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.885 . . . . 0.0 110.008 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.46 HG12 HG21 ' A' ' 131' ' ' VAL . 2.9 t -75.06 -27.04 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.351 -0.843 . . . . 0.0 109.903 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.451 ' NE2' HG11 ' A' ' 131' ' ' VAL . 95.7 mt-30 -85.7 -28.24 24.79 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.411 -0.806 . . . . 0.0 109.985 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.528 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 7.4 t -53.44 -24.79 13.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.903 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.586 ' CD1' HD22 ' A' ' 64' ' ' LEU . 42.0 mt -70.53 -38.48 74.25 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.392 -0.818 . . . . 0.0 109.955 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.528 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 14.4 ttpt -55.6 -24.81 35.1 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.245 -0.909 . . . . 0.0 109.888 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.16 -18.99 13.85 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.29 -0.881 . . . . 0.0 110.131 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.462 ' CZ ' ' HB3' ' A' ' 67' ' ' HIS . 5.4 t80 -60.01 95.43 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.231 -0.918 . . . . 0.0 110.099 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -119.5 146.63 45.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.327 -0.858 . . . . 0.0 110.164 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -166.73 100.49 0.57 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.205 -0.935 . . . . 0.0 110.218 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.462 ' O ' ' CB ' ' A' ' 113' ' ' ASP . 3.4 p -124.85 35.23 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.219 -0.926 . . . . 0.0 110.328 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.462 ' CB ' ' O ' ' A' ' 112' ' ' VAL . 0.4 OUTLIER 67.59 -174.86 0.19 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.166 -0.959 . . . . 0.0 110.231 179.937 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.58 -48.47 63.15 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.202 -0.936 . . . . 0.0 110.306 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -149.77 137.71 20.3 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.241 -0.912 . . . . 0.0 110.257 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 177.43 -154.28 15.23 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 118' ' ' ASP . 0.8 OUTLIER -121.17 109.36 14.9 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.328 -1.101 . . . . 0.0 110.082 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.411 ' C ' ' O ' ' A' ' 117' ' ' LYS . 11.9 t0 -43.59 99.63 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.262 -0.899 . . . . 0.0 110.27 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.41 ' N ' ' O ' ' A' ' 117' ' ' LYS . 0.1 OUTLIER -100.36 -9.57 22.12 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.219 -0.925 . . . . 0.0 110.4 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -88.92 57.08 4.06 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.555 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.1 p -90.59 -44.34 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.273 -1.134 . . . . 0.0 110.353 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.555 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.2 m-80 -40.91 -46.94 2.89 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.482 -0.761 . . . . 0.0 110.271 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.536 ' CG1' HG13 ' A' ' 74' ' ' VAL . 0.9 OUTLIER -66.33 -42.92 91.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.319 -0.863 . . . . 0.0 109.867 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.528 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -56.87 -67.85 0.27 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.188 -0.945 . . . . 0.0 111.063 -179.554 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.18 -35.95 76.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.284 -0.885 . . . . 0.0 111.331 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 0.0 OUTLIER -57.56 -54.14 50.2 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.111 -0.993 . . . . 0.0 110.446 -179.561 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.464 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -57.25 -40.8 78.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.38 -0.825 . . . . 0.0 110.068 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt -62.5 -33.72 75.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.183 -0.948 . . . . 0.0 110.241 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.71 -40.27 96.63 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.287 -0.883 . . . . 0.0 110.586 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.523 HD11 ' CA ' ' A' ' 82' ' ' GLU . 0.6 OUTLIER -62.5 -53.05 60.44 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.248 -0.907 . . . . 0.0 110.569 -179.677 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.46 HG21 HG12 ' A' ' 103' ' ' VAL . 25.3 t -65.84 -25.68 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.408 -0.807 . . . . 0.0 110.413 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 135' ' ' ARG . . . -65.92 -55.55 16.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.25 -0.906 . . . . 0.0 110.509 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.85 -56.94 15.17 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.137 -0.977 . . . . 0.0 110.307 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.527 ' CD1' HG21 ' A' ' 85' ' ' ILE . 3.0 mp -46.34 -52.37 12.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.23 -0.919 . . . . 0.0 110.136 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 132' ' ' ALA . 4.4 tpt180 -99.87 117.38 34.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.245 -0.91 . . . . 0.0 110.075 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -146.16 -38.32 0.24 Allowed 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.203 -0.935 . . . . 0.0 110.43 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -109.44 166.93 10.5 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.152 -0.968 . . . . 0.0 110.265 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.64 125.65 12.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.314 -0.866 . . . . 0.0 110.291 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -68.14 0.19 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 0.0 110.219 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.73 178.23 0.12 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.276 -0.89 . . . . 0.0 110.251 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -120.94 -18.32 7.6 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.25 -0.906 . . . . 0.0 110.139 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -103.17 -164.75 1.1 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.272 -0.892 . . . . 0.0 110.262 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -164.57 41.21 0.08 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 40.0 mtt180 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.207 179.992 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.76 -17.33 24.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.328 -1.101 . . . . 0.0 110.15 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 59.8 p -61.15 -158.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.21 -0.932 . . . . 0.0 110.16 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 40.2 mtm-85 -100.99 15.93 27.04 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.234 -0.916 . . . . 0.0 110.208 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.401 ' O ' ' C ' ' A' ' 2' ' ' SER . 32.3 mmm 50.91 30.14 4.99 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.181 -0.949 . . . . 0.0 110.266 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.401 ' C ' ' O ' ' A' ' 1' ' ' MET . 41.8 t 44.71 61.49 2.44 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.182 -0.949 . . . . 0.0 110.217 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 47.0 p -56.45 -27.3 56.41 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.212 -0.93 . . . . 0.0 110.268 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 54.96 40.41 32.0 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.266 -0.896 . . . . 0.0 110.198 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.9 t 52.63 -171.49 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.262 -0.899 . . . . 0.0 110.254 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.98 128.36 15.9 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.175 -0.953 . . . . 0.0 110.232 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -80.16 152.57 29.14 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.28 -0.887 . . . . 0.0 110.24 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.427 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -117.38 149.53 40.37 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.235 -0.915 . . . . 0.0 110.266 -179.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -149.87 132.78 16.1 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.224 -0.922 . . . . 0.0 110.211 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.8 mtt -132.41 -145.76 0.27 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.292 -0.88 . . . . 0.0 110.261 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.7 mtmp? -75.06 -56.91 4.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 110.295 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.1 m120 49.06 32.83 4.22 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.213 -0.929 . . . . 0.0 110.181 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.497 HG23 ' N ' ' A' ' 14' ' ' VAL . 2.3 tt -98.16 -23.66 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.273 -0.892 . . . . 0.0 110.184 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.497 ' N ' HG23 ' A' ' 13' ' ' ILE . 5.3 t -70.63 94.59 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.26 -0.9 . . . . 0.0 110.155 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -94.15 92.26 7.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.282 -0.887 . . . . 0.0 110.259 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -130.8 16.81 5.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.231 -0.918 . . . . 0.0 110.176 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.514 ' CD1' ' O ' ' A' ' 17' ' ' TYR . 41.1 p90 -80.63 136.25 36.19 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.889 . . . . 0.0 110.184 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.468 ' O ' ' HB3' ' A' ' 19' ' ' GLU . 30.7 t -111.17 -45.48 3.42 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.29 -0.881 . . . . 0.0 110.125 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.505 ' HB2' ' CD1' ' A' ' 22' ' ' ILE . 0.1 OUTLIER 175.26 48.69 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.25 -0.906 . . . . 0.0 110.23 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.524 ' CB ' HD22 ' A' ' 46' ' ' LEU . . . -64.89 -56.8 11.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 110.216 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' A' ' 20' ' ' ALA . 18.8 pt-20 -42.96 -28.52 0.26 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.255 -0.903 . . . . 0.0 110.039 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.505 ' CD1' ' HB2' ' A' ' 19' ' ' GLU . 40.8 mt -74.19 -57.65 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.314 -0.866 . . . . 0.0 110.037 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.469 ' CB ' HG12 ' A' ' 43' ' ' ILE . 1.8 mmpt? -48.09 -51.05 26.14 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.351 -0.843 . . . . 0.0 110.214 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.531 HG21 HG22 ' A' ' 56' ' ' ILE . 20.0 t -56.28 -36.28 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.286 -0.884 . . . . 0.0 110.207 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.4 ttt85 -67.05 -38.14 85.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.2 -0.937 . . . . 0.0 110.177 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.431 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -81.18 -14.75 57.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.265 -0.897 . . . . 0.0 109.966 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.578 ' CB ' ' CD2' ' A' ' 39' ' ' LEU . . . -77.72 -20.29 53.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.867 . . . . 0.0 110.244 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.482 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 30.2 p -126.01 61.9 1.26 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.226 -0.921 . . . . 0.0 110.251 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.47 ' OG ' ' O ' ' A' ' 29' ' ' SER . 3.2 p -179.6 106.42 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 0.0 110.17 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -83.99 0.65 47.17 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.256 -0.902 . . . . 0.0 110.241 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.569 ' CB ' ' CD ' ' A' ' 32' ' ' PRO . 0.5 OUTLIER -52.95 -60.12 7.4 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.315 -0.866 . . . . 0.0 110.289 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.569 ' CD ' ' CB ' ' A' ' 31' ' ' ASP . 19.5 Cg_endo -64.57 -176.54 0.43 Allowed 'Trans proline' 0 C--N 1.306 -1.706 0 O-C-N 123.947 1.499 . . . . 0.0 110.321 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.406 ' C ' ' O ' ' A' ' 32' ' ' PRO . 1.0 OUTLIER -43.09 -87.15 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.276 -0.89 . . . . 0.0 110.644 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 175.06 -167.69 39.91 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -57.98 150.79 61.95 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 O-C-N 124.054 1.555 . . . . 0.0 110.498 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.2 m -142.61 125.32 15.93 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.265 -0.897 . . . . 0.0 110.13 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.4 t 48.98 48.42 20.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.282 -0.886 . . . . 0.0 110.199 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 t 58.06 100.73 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.299 -0.875 . . . . 0.0 110.149 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.578 ' CD2' ' CB ' ' A' ' 27' ' ' ALA . 0.6 OUTLIER -89.2 -9.55 50.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.345 -0.847 . . . . 0.0 110.263 -179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.512 ' CE ' HG22 ' A' ' 79' ' ' THR . 6.9 mmm -84.79 -45.79 12.01 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.186 -0.946 . . . . 0.0 110.207 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.466 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.2 OUTLIER -63.97 -29.34 70.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.355 -0.84 . . . . 0.0 110.277 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -72.77 -49.64 29.55 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.938 . . . . 0.0 110.102 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.517 HD11 HG23 ' A' ' 43' ' ' ILE . 44.7 mt -55.91 -33.87 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.273 -0.892 . . . . 0.0 110.022 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.564 ' HB1' HD22 ' A' ' 84' ' ' LEU . . . -71.63 -52.9 15.56 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.236 -0.915 . . . . 0.0 109.401 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.449 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 7.4 t70 -51.82 -22.38 3.63 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.059 -1.025 . . . . 0.0 108.742 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.524 HD22 ' CB ' ' A' ' 20' ' ' ALA . 8.1 mt -78.24 -40.03 38.47 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.611 -0.681 . . . . 0.0 110.017 179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.542 HG22 HG21 ' A' ' 92' ' ' VAL . 73.1 p -49.69 -42.0 44.64 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.11 -0.994 . . . . 0.0 109.159 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.561 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 83.7 m-85 -45.52 -46.27 13.85 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.234 -0.916 . . . . 0.0 109.367 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 50' ' ' VAL . 22.7 m-20 -71.14 89.65 0.85 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.529 -0.732 . . . . 0.0 110.358 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.73 -57.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.561 178.228 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.555 HG11 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -63.07 -65.9 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.04 -1.037 . . . . 0.0 110.069 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.555 ' N ' HG11 ' A' ' 51' ' ' VAL . . . -38.16 -42.43 0.67 Allowed 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.305 0.574 . . . . 0.0 110.602 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.538 ' CE1' HG23 ' A' ' 92' ' ' VAL . 10.0 t80 -59.56 -53.65 55.67 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.376 -0.828 . . . . 0.0 109.952 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -30.36 62.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.28 -0.887 . . . . 0.0 109.745 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.68 -25.67 41.18 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.307 -0.871 . . . . 0.0 110.178 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.531 HG22 HG21 ' A' ' 24' ' ' VAL . 6.9 mt -77.59 -70.18 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.324 -0.86 . . . . 0.0 110.283 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.472 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 91.6 mmm -47.75 -36.31 11.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.21 -0.931 . . . . 0.0 109.91 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 t -55.21 -60.67 3.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.377 -0.827 . . . . 0.0 109.971 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.27 -25.6 65.83 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -0.953 . . . . 0.0 109.687 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.536 HD12 ' CD2' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -71.1 -29.59 37.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.379 -0.825 . . . . 0.0 109.506 179.641 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.558 ' CE3' HD12 ' A' ' 64' ' ' LEU . 13.4 m95 -78.21 -41.04 35.69 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.239 -0.913 . . . . 0.0 109.964 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.78 -53.03 53.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.329 -0.857 . . . . 0.0 109.964 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.467 ' HB3' ' HB3' ' A' ' 73' ' ' HIS . 4.0 mmt180 -70.06 -33.83 72.43 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.381 -0.824 . . . . 0.0 109.992 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.607 HD22 ' CD1' ' A' ' 106' ' ' LEU . 11.8 mt -65.11 -9.45 22.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.447 -0.783 . . . . 0.0 110.357 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.451 ' O ' ' C ' ' A' ' 66' ' ' ASP . 1.4 m-20 -87.83 31.51 0.77 Allowed 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.307 -0.87 . . . . 0.0 110.156 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.566 ' HB2' ' CZ ' ' A' ' 109' ' ' PHE . 4.4 p30 37.28 -158.36 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 121.805 0.812 . . . . 0.0 110.801 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.422 ' CB ' ' O ' ' A' ' 66' ' ' ASP . 0.1 OUTLIER 172.92 -155.41 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.636 -0.665 . . . . 0.0 109.977 -179.814 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -66.53 -100.68 0.02 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.17 43.31 1.29 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.256 -1.144 . . . . 0.0 110.288 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -129.71 41.81 3.38 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.325 -0.859 . . . . 0.0 110.409 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.447 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 35.7 p-90 -62.62 -13.24 29.41 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.198 -0.939 . . . . 0.0 110.048 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -52.56 -39.59 61.66 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.392 -0.817 . . . . 0.0 110.287 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.467 ' HB3' ' HB3' ' A' ' 63' ' ' ARG . 5.0 m-70 -61.99 -36.81 82.6 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.207 -0.933 . . . . 0.0 110.111 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.543 HG12 ' HE1' ' A' ' 78' ' ' MET . 24.5 t -59.06 -54.54 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.31 -0.869 . . . . 0.0 110.125 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.447 ' HA ' ' HE3' ' A' ' 78' ' ' MET . 22.7 t80 -49.91 -56.45 10.5 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.183 -0.948 . . . . 0.0 109.995 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.482 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -59.74 -25.81 65.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.352 -0.843 . . . . 0.0 110.036 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.532 ' HB1' ' CD2' ' A' ' 64' ' ' LEU . . . -73.12 -27.43 61.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.317 -0.864 . . . . 0.0 110.038 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.543 ' HE1' HG12 ' A' ' 74' ' ' VAL . 1.5 mpp? -74.76 -32.96 62.21 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.327 -0.858 . . . . 0.0 109.991 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.512 HG22 ' CE ' ' A' ' 40' ' ' MET . 35.9 m -74.69 -27.74 60.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.399 -0.813 . . . . 0.0 110.283 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.536 ' CD2' HD12 ' A' ' 60' ' ' ILE . 19.5 tp -76.09 -53.49 8.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.161 -0.962 . . . . 0.0 109.378 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.512 ' O ' ' CD1' ' A' ' 85' ' ' ILE . 6.5 ttp -61.39 -20.62 63.24 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.158 -0.964 . . . . 0.0 109.724 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.502 ' CB ' HD13 ' A' ' 130' ' ' LEU . 13.4 tm-20 -88.36 -33.49 17.93 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.167 -0.958 . . . . 0.0 110.354 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.488 ' CD1' ' O ' ' A' ' 83' ' ' TYR . 10.5 t80 -79.87 -21.92 43.48 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.269 -0.894 . . . . 0.0 110.467 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.564 HD22 ' HB1' ' A' ' 44' ' ' ALA . 68.5 mt -88.86 -34.74 16.89 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.261 -0.899 . . . . 0.0 110.021 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.524 HG21 ' CD2' ' A' ' 134' ' ' LEU . 37.5 mt -56.95 -22.95 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.061 -1.024 . . . . 0.0 109.972 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -95.24 -80.49 0.41 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.233 -0.917 . . . . 0.0 110.284 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.471 HG21 ' CB ' ' A' ' 44' ' ' ALA . 7.9 t -75.65 -24.44 56.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.254 -0.904 . . . . 0.0 110.319 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.561 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -49.34 -77.29 0.13 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.0 t 177.09 154.16 0.24 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.251 -1.146 . . . . 0.0 110.31 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 1.6 mt-10 -55.92 -17.19 5.91 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.902 . . . . 0.0 110.303 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -77.02 -38.02 53.81 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.181 -0.949 . . . . 0.0 110.11 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.542 HG21 HG22 ' A' ' 47' ' ' THR . 73.1 t -59.67 -38.96 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.213 -0.929 . . . . 0.0 110.084 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.91 -40.24 72.28 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.881 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 90' ' ' GLU . 5.6 mt-30 -60.72 -39.77 89.81 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.229 -0.919 . . . . 0.0 109.994 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.408 ' HA ' ' OE1' ' A' ' 95' ' ' GLN . 3.5 tp60 -65.07 -39.59 93.46 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.321 -0.862 . . . . 0.0 109.259 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.513 ' CB ' HD11 ' A' ' 134' ' ' LEU . 2.8 m -56.2 -41.31 75.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.341 -0.849 . . . . 0.0 109.503 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 22.0 mtmt -67.56 -32.46 73.25 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.497 -0.752 . . . . 0.0 109.441 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -80.31 -14.32 58.47 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.411 -0.805 . . . . 0.0 109.68 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -129.86 33.4 4.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.452 -0.78 . . . . 0.0 110.08 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.526 ' HE1' ' CE2' ' A' ' 101' ' ' TYR . 8.4 ptt? -60.74 -28.94 69.07 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.247 -0.908 . . . . 0.0 110.252 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.526 ' CE2' ' HE1' ' A' ' 100' ' ' MET . 41.5 m-85 -65.61 -26.4 67.81 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.337 -0.852 . . . . 0.0 110.198 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.506 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -76.65 -41.4 45.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 110.133 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.526 HG13 ' CG2' ' A' ' 131' ' ' VAL . 2.5 t -73.2 -25.85 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.324 -0.86 . . . . 0.0 109.989 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.421 ' CG ' HG12 ' A' ' 131' ' ' VAL . 16.7 mt-30 -87.65 -24.82 23.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.287 -0.883 . . . . 0.0 110.452 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.506 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 12.0 t -63.59 -12.61 34.57 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.186 -0.946 . . . . 0.0 110.368 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.607 ' CD1' HD22 ' A' ' 64' ' ' LEU . 17.4 mt -73.86 -40.05 63.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.189 -0.944 . . . . 0.0 110.219 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.486 ' HG3' ' N ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -49.17 -24.84 1.86 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.161 -0.962 . . . . 0.0 110.025 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.486 ' N ' ' HG3' ' A' ' 107' ' ' LYS . 10.8 t0 -93.72 -31.44 14.43 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.269 -0.894 . . . . 0.0 110.249 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.566 ' CZ ' ' HB2' ' A' ' 66' ' ' ASP . 1.3 t80 -49.09 115.13 1.18 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.188 -0.945 . . . . 0.0 110.223 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.471 ' CG ' ' O ' ' A' ' 110' ' ' GLN . 10.7 pt20 -154.1 120.13 5.33 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.325 -0.859 . . . . 0.0 109.902 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.493 ' C ' ' CD1' ' A' ' 111' ' ' TYR . 1.5 t80 -168.52 113.21 0.61 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.253 -0.904 . . . . 0.0 110.263 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.521 ' CG2' ' HA ' ' A' ' 118' ' ' ASP . 73.7 t -88.29 -100.61 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.26 -0.9 . . . . 0.0 110.019 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.434 ' N ' ' CG1' ' A' ' 112' ' ' VAL . 0.2 OUTLIER -153.78 -165.92 2.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.081 -1.012 . . . . 0.0 110.106 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 18.7 ptt-85 -46.47 -46.48 18.98 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.262 -0.898 . . . . 0.0 109.888 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -154.94 40.69 0.44 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.463 -0.773 . . . . 0.0 110.049 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -81.53 -158.55 21.57 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.403 ' C ' HG22 ' A' ' 112' ' ' VAL . 73.8 tttt -122.91 138.26 54.72 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.321 -1.106 . . . . 0.0 110.297 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.521 ' HA ' ' CG2' ' A' ' 112' ' ' VAL . 6.0 t0 -47.55 112.94 0.61 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.315 -0.866 . . . . 0.0 110.072 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -143.12 39.29 1.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.243 -0.91 . . . . 0.0 110.346 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -127.53 38.98 2.01 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.561 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.9 p -82.51 -43.64 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.222 -1.164 . . . . 0.0 110.26 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.561 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 2.6 t30 -40.56 -27.68 0.05 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.595 -0.69 . . . . 0.0 110.257 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.523 ' CG1' HG13 ' A' ' 74' ' ' VAL . 2.0 t -76.74 -49.23 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.245 -0.909 . . . . 0.0 109.968 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -60.34 -36.8 78.81 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.116 -0.99 . . . . 0.0 110.802 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -77.93 -61.41 2.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.183 -0.948 . . . . 0.0 110.88 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -48.65 -44.52 37.62 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.151 -0.968 . . . . 0.0 110.268 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.482 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -65.38 -44.14 88.49 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.298 -0.876 . . . . 0.0 110.411 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -49.79 -39.13 37.12 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.186 -0.946 . . . . 0.0 110.505 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -71.31 -50.95 27.31 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.221 -0.924 . . . . 0.0 110.438 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.502 HD13 ' CB ' ' A' ' 82' ' ' GLU . 11.9 tp -49.48 -22.31 1.17 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.247 -0.908 . . . . 0.0 110.317 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.526 ' CG2' HG13 ' A' ' 103' ' ' VAL . 42.8 t -92.19 -31.76 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 110.304 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.408 ' O ' ' C ' ' A' ' 133' ' ' LEU . . . -70.37 -63.13 1.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.318 -0.864 . . . . 0.0 110.302 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.408 ' C ' ' O ' ' A' ' 132' ' ' ALA . 13.2 tp -43.53 -27.42 0.29 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.228 -0.92 . . . . 0.0 110.351 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.524 ' CD2' HG21 ' A' ' 85' ' ' ILE . 20.5 mt -77.9 -57.5 3.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.914 . . . . 0.0 110.335 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -105.26 54.93 0.7 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.167 -0.958 . . . . 0.0 110.196 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -81.9 -67.7 0.76 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.342 -0.849 . . . . 0.0 110.292 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -100.0 168.8 9.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.221 -0.924 . . . . 0.0 110.292 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -143.52 164.44 30.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.14 -0.975 . . . . 0.0 110.328 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.407 ' O ' ' C ' ' A' ' 140' ' ' LEU . 10.0 mtm180 -51.95 -84.14 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.27 -0.894 . . . . 0.0 110.324 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 139' ' ' ARG . 0.9 OUTLIER 43.58 78.07 0.06 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.194 -0.941 . . . . 0.0 110.162 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -56.61 143.97 33.81 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.294 -0.879 . . . . 0.0 110.433 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.454 ' CG ' ' O ' ' A' ' 142' ' ' GLU . 0.1 OUTLIER -79.34 95.51 5.73 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.377 -0.827 . . . . 0.0 110.078 179.879 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -51.33 116.83 2.24 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.283 -0.885 . . . . 0.0 110.261 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.193 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -136.07 127.9 29.26 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.337 -1.096 . . . . 0.0 110.095 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.71 76.92 0.45 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 110.211 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -115.31 -177.71 3.2 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.257 -0.902 . . . . 0.0 110.196 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -103.89 -5.1 22.65 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.278 -0.889 . . . . 0.0 110.167 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.46 138.52 3.02 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.169 -0.957 . . . . 0.0 110.252 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.4 p -117.78 9.99 13.15 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.295 -0.878 . . . . 0.0 110.264 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.03 39.13 3.6 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.208 -0.932 . . . . 0.0 110.228 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -172.11 2.08 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.292 -0.88 . . . . 0.0 110.224 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.44 170.65 8.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.258 -0.901 . . . . 0.0 110.102 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.4 mtt85 -118.31 7.95 12.13 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.217 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.5 mmt-85 -59.18 143.1 49.92 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.361 -0.837 . . . . 0.0 110.258 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -139.73 80.14 1.75 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.254 -0.904 . . . . 0.0 110.186 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -97.59 -28.38 13.96 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.16 153.85 6.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.221 -0.925 . . . . 0.0 110.252 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.433 ' O ' ' HB ' ' A' ' 13' ' ' ILE . 18.0 p-10 -149.47 55.78 0.97 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.404 -0.81 . . . . 0.0 110.134 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.433 ' HB ' ' O ' ' A' ' 12' ' ' ASN . 19.5 mt 60.5 164.74 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.237 -0.914 . . . . 0.0 110.168 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.9 m -139.12 114.9 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.263 -0.898 . . . . 0.0 110.287 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.61 -155.31 0.49 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 110.341 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.462 ' OD1' HG23 ' A' ' 51' ' ' VAL . 34.6 t-20 -70.04 -32.6 70.8 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.297 -0.877 . . . . 0.0 110.329 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -74.28 140.14 44.74 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.219 -0.926 . . . . 0.0 110.286 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -117.57 7.38 12.64 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.211 -0.93 . . . . 0.0 110.14 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.446 ' O ' ' HB ' ' A' ' 22' ' ' ILE . 4.5 mt-10 54.52 21.65 3.47 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.294 -0.879 . . . . 0.0 110.344 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.521 ' HB3' ' CD1' ' A' ' 46' ' ' LEU . . . -57.19 -50.45 72.8 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.918 . . . . 0.0 110.095 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.46 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 1.2 pt-20 -48.52 -28.06 3.12 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.203 -0.936 . . . . 0.0 109.897 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.446 ' HB ' ' O ' ' A' ' 19' ' ' GLU . 49.3 mm -73.29 -41.47 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.295 -0.878 . . . . 0.0 109.904 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.456 ' CB ' HG12 ' A' ' 43' ' ' ILE . 11.6 mmtt -64.56 -42.75 95.47 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.253 -0.904 . . . . 0.0 109.907 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.522 HG13 ' CD2' ' A' ' 80' ' ' LEU . 14.8 t -64.81 -30.65 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.264 -0.897 . . . . 0.0 110.03 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -62.34 -42.69 99.59 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.201 -0.937 . . . . 0.0 110.04 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -83.44 -19.88 35.12 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.48 -0.763 . . . . 0.0 110.108 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.464 ' CB ' ' CD2' ' A' ' 39' ' ' LEU . . . -81.25 -14.16 57.74 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.307 -0.87 . . . . 0.0 110.25 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.473 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 3.8 p -103.09 7.36 38.86 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.24 -0.912 . . . . 0.0 110.292 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 36.1 t -85.78 -80.7 0.22 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.141 -0.974 . . . . 0.0 110.198 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.417 ' O ' ' CB ' ' A' ' 31' ' ' ASP . 1.1 t-20 178.73 -58.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.302 -0.873 . . . . 0.0 109.976 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.417 ' CB ' ' O ' ' A' ' 30' ' ' ASN . 0.1 OUTLIER 64.23 89.23 0.11 Allowed Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.346 -0.846 . . . . 0.0 110.332 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -61.86 -168.28 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.035 1.545 . . . . 0.0 110.167 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.407 ' O ' ' O ' ' A' ' 34' ' ' GLY . 0.5 OUTLIER 57.52 173.04 0.05 OUTLIER 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.268 -0.895 . . . . 0.0 110.473 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.407 ' O ' ' O ' ' A' ' 33' ' ' TRP . . . -58.09 -164.23 0.07 OUTLIER Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.423 ' O ' ' O ' ' A' ' 36' ' ' SER . 18.4 Cg_endo -65.06 -76.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.77 0 O-C-N 123.985 1.519 . . . . 0.0 110.292 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 35' ' ' PRO . 1.3 m 61.57 136.05 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.31 -0.869 . . . . 0.0 110.238 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 63.28 167.69 0.14 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.906 . . . . 0.0 110.239 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.9 t -129.1 101.58 6.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.312 -0.868 . . . . 0.0 110.039 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.464 ' CD2' ' CB ' ' A' ' 27' ' ' ALA . 1.9 tp -109.72 -45.76 3.61 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.282 -0.886 . . . . 0.0 110.369 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -44.45 77.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.266 -0.896 . . . . 0.0 110.497 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.46 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.1 OUTLIER -66.5 -28.25 68.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.171 -0.956 . . . . 0.0 110.589 -179.767 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.68 -47.73 44.97 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.203 -0.936 . . . . 0.0 110.257 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.492 HG21 ' CG2' ' A' ' 24' ' ' VAL . 62.6 mt -57.25 -36.09 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.177 -0.952 . . . . 0.0 110.029 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.496 ' O ' ' OG1' ' A' ' 47' ' ' THR . . . -70.33 -49.84 45.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.174 -0.954 . . . . 0.0 109.522 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -51.25 -22.27 2.61 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.029 -1.044 . . . . 0.0 108.831 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.521 ' CD1' ' HB3' ' A' ' 20' ' ' ALA . 12.4 mt -81.99 -37.99 25.79 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.623 -0.673 . . . . 0.0 110.245 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.498 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 71.8 p -50.51 -40.53 51.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.111 -0.993 . . . . 0.0 109.474 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 49' ' ' ASN . 66.9 m-85 -44.61 -46.75 10.23 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 119.624 -0.83 . . . . 0.0 109.122 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.473 ' O ' ' O ' ' A' ' 48' ' ' TYR . 0.8 OUTLIER -55.62 -158.76 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 CA-C-O 121.98 0.895 . . . . 0.0 110.498 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.428 ' CG2' ' N ' ' A' ' 51' ' ' VAL . 3.1 m -125.5 -34.67 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -178.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.554 HG11 ' N ' ' A' ' 52' ' ' ALA . 8.5 t -82.88 -70.64 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 CA-C-O 122.07 0.938 . . . . 0.0 109.618 178.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.554 ' N ' HG11 ' A' ' 51' ' ' VAL . . . -40.37 -41.58 1.4 Allowed 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.247 -178.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.575 ' CE1' HG22 ' A' ' 92' ' ' VAL . 12.6 t80 -56.2 -52.6 63.84 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.471 -0.768 . . . . 0.0 109.861 179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.452 ' O ' ' HB2' ' A' ' 58' ' ' SER . 40.9 t -60.49 -26.86 67.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.316 -0.865 . . . . 0.0 109.643 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.46 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 1.7 mm-40 -81.45 -21.56 38.74 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.47 -0.769 . . . . 0.0 109.782 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.519 HG21 HG23 ' A' ' 24' ' ' VAL . 7.7 mt -81.78 -70.12 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.328 -0.857 . . . . 0.0 109.851 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.458 ' HA ' HD13 ' A' ' 60' ' ' ILE . 79.8 mmm -49.73 -36.68 26.42 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.31 -0.869 . . . . 0.0 109.73 179.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 54' ' ' SER . 2.2 m -55.83 -60.41 3.5 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.316 -0.865 . . . . 0.0 109.696 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.38 -23.84 62.93 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.253 -0.904 . . . . 0.0 109.674 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.557 HG21 HD13 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -71.64 -33.14 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.427 -0.796 . . . . 0.0 109.569 179.776 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.452 ' CH2' ' HE3' ' A' ' 81' ' ' MET . 28.2 m95 -77.91 -31.35 51.12 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.212 -0.93 . . . . 0.0 109.998 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.93 -57.51 7.69 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.271 -0.893 . . . . 0.0 110.108 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.421 ' O ' HG22 ' A' ' 74' ' ' VAL . 13.7 mmt180 -66.42 -9.89 38.43 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.191 -0.943 . . . . 0.0 109.906 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.558 HD22 ' HB1' ' A' ' 77' ' ' ALA . 6.2 mt -84.83 -17.65 37.4 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.343 -0.848 . . . . 0.0 110.325 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.472 ' O ' ' O ' ' A' ' 66' ' ' ASP . 25.0 m-20 -110.55 43.05 1.46 Allowed 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.238 -0.914 . . . . 0.0 109.904 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.527 ' OD1' ' CE2' ' A' ' 109' ' ' PHE . 5.5 p-10 -52.73 -167.88 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.453 -0.779 . . . . 0.0 110.408 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.75 -175.49 4.46 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.294 -0.878 . . . . 0.0 110.257 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 49.46 -112.6 1.41 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.456 ' O ' ' CG ' ' A' ' 69' ' ' LYS . 1.0 OUTLIER -130.62 57.87 1.71 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.284 -1.127 . . . . 0.0 110.134 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -131.12 32.32 4.3 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.207 -0.933 . . . . 0.0 110.49 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.465 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . 70.0 p-90 -57.13 -18.14 13.76 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.14 -0.975 . . . . 0.0 110.142 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 13.2 mtp180 -52.63 -41.89 64.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.22 -0.925 . . . . 0.0 110.234 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.403 ' CE1' ' NH1' ' A' ' 63' ' ' ARG . 10.0 m170 -60.62 -41.59 95.17 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.192 -0.943 . . . . 0.0 110.085 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.55 HG12 ' HE2' ' A' ' 78' ' ' MET . 24.7 t -56.05 -50.8 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.289 -0.882 . . . . 0.0 110.022 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.558 ' CE1' ' O ' ' A' ' 122' ' ' ASN . 7.4 t80 -49.47 -56.7 8.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.207 -0.933 . . . . 0.0 110.226 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -59.19 -26.93 65.24 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.196 -0.94 . . . . 0.0 109.951 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.558 ' HB1' HD22 ' A' ' 64' ' ' LEU . . . -70.15 -28.68 65.54 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 110.182 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.55 ' HE2' HG12 ' A' ' 74' ' ' VAL . 1.6 mpp? -76.43 -32.08 58.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.405 -0.809 . . . . 0.0 110.229 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 9.9 m -66.9 -40.18 87.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.082 -1.011 . . . . 0.0 110.122 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.542 ' HG ' ' CD1' ' A' ' 84' ' ' LEU . 16.2 tp -64.94 -54.14 35.42 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.333 -0.854 . . . . 0.0 109.783 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.509 ' CG ' HD13 ' A' ' 85' ' ' ILE . 0.2 OUTLIER -59.19 -25.27 63.81 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.868 . . . . 0.0 109.887 179.561 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.531 ' CA ' HD11 ' A' ' 130' ' ' LEU . 0.9 OUTLIER -78.46 -34.13 47.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.252 -0.905 . . . . 0.0 110.385 179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.46 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 26.0 t80 -85.6 -16.61 38.72 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.262 -0.899 . . . . 0.0 110.714 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.542 ' CD1' ' HG ' ' A' ' 80' ' ' LEU . 85.1 mt -92.54 -38.98 11.62 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.166 -0.959 . . . . 0.0 110.232 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.536 ' CD1' HD23 ' A' ' 130' ' ' LEU . 52.0 mt -57.1 -17.19 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.115 -0.991 . . . . 0.0 109.807 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.58 -80.54 0.47 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.294 -0.879 . . . . 0.0 110.191 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.458 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 15.0 t -77.72 -18.77 56.22 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.201 -0.937 . . . . 0.0 110.142 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.464 ' HA3' ' O ' ' A' ' 84' ' ' LEU . . . -55.99 -74.35 0.33 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.212 -1.555 . . . . 0.0 109.212 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.409 ' OG ' ' HA ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER 174.47 152.43 0.11 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -1.12 . . . . 0.0 110.337 179.767 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -51.98 -24.43 6.53 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 110.109 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.51 ' O ' ' HG2' ' A' ' 94' ' ' GLN . 40.4 mtt180 -70.26 -44.23 68.88 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.304 -0.873 . . . . 0.0 109.722 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.575 HG22 ' CE1' ' A' ' 53' ' ' PHE . 39.7 t -59.04 -22.16 21.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 120.874 -1.141 . . . . 0.0 108.995 179.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.475 ' HB2' HG23 ' A' ' 85' ' ' ILE . 1.9 t -95.18 -19.2 20.26 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.585 -0.697 . . . . 0.0 110.49 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.598 ' CG ' ' N ' ' A' ' 95' ' ' GLN . 7.2 pt20 -79.53 -48.2 14.26 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.93 -1.106 . . . . 0.0 109.104 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.598 ' N ' ' CG ' ' A' ' 94' ' ' GLN . 7.9 tt0 -63.12 -36.45 83.65 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.449 ' SG ' HD23 ' A' ' 134' ' ' LEU . 36.4 t -59.77 -36.27 76.32 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.344 -0.848 . . . . 0.0 109.403 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.18 -35.53 66.41 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.417 -0.802 . . . . 0.0 109.466 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -74.46 -18.29 60.65 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.481 -0.762 . . . . 0.0 109.652 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -121.97 36.8 4.53 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.511 -0.743 . . . . 0.0 109.988 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.0 tpp -59.57 -30.19 68.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.196 -0.94 . . . . 0.0 110.032 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.453 ' O ' ' HB ' ' A' ' 105' ' ' THR . 17.5 m-85 -62.03 -30.04 70.69 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.287 -0.883 . . . . 0.0 109.878 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.5 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -70.34 -40.18 74.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.341 -0.849 . . . . 0.0 110.13 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.493 HG23 ' CE ' ' A' ' 81' ' ' MET . 4.6 t -74.86 -27.84 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.354 -0.841 . . . . 0.0 110.332 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.513 ' O ' ' CG ' ' A' ' 107' ' ' LYS . 2.0 mm100 -88.63 -19.51 26.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.314 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.5 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 11.0 t -67.14 -14.73 63.18 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.17 -0.956 . . . . 0.0 109.985 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.554 ' CD1' HD23 ' A' ' 64' ' ' LEU . 56.6 mt -77.01 -37.82 54.29 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.348 -0.845 . . . . 0.0 110.169 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.523 ' HA ' ' CB ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -53.93 -20.17 5.71 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.276 -0.89 . . . . 0.0 110.085 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.3 -30.0 17.76 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.308 -0.87 . . . . 0.0 110.322 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.527 ' CE2' ' OD1' ' A' ' 66' ' ' ASP . 0.1 OUTLIER -44.92 108.32 0.12 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.232 -0.917 . . . . 0.0 110.236 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.424 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 15.0 pt20 -145.1 112.87 6.33 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.274 -0.892 . . . . 0.0 110.247 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.3 100.95 6.27 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.206 -0.934 . . . . 0.0 110.278 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 3.1 p -138.0 27.49 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.208 -0.933 . . . . 0.0 110.365 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.32 -79.33 0.09 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.239 -0.913 . . . . 0.0 110.202 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -47.16 60.38 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.276 -0.89 . . . . 0.0 110.379 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.32 -89.33 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.234 -0.916 . . . . 0.0 110.14 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 120.7 11.02 6.71 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -122.85 97.53 5.49 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.223 -1.163 . . . . 0.0 110.261 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.82 114.14 1.0 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.301 -0.875 . . . . 0.0 110.114 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -147.06 26.08 1.1 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.164 -0.96 . . . . 0.0 110.2 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -116.22 43.6 1.63 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.555 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.4 p -93.12 -42.8 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.253 -1.145 . . . . 0.0 110.213 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.558 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 20.7 m-20 -37.16 -28.77 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.8 -0.562 . . . . 0.0 110.788 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.541 ' CG1' HG12 ' A' ' 74' ' ' VAL . 20.4 t -86.25 -63.06 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.247 -0.908 . . . . 0.0 110.303 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.523 ' CB ' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -41.96 -34.01 0.63 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.154 -0.966 . . . . 0.0 110.935 -179.578 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -82.18 -54.57 5.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.084 -1.01 . . . . 0.0 111.311 -179.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.516 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -50.72 -50.14 56.07 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.969 -1.082 . . . . 0.0 110.338 -179.395 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.443 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -61.22 -42.87 99.36 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.38 -0.825 . . . . 0.0 110.408 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -55.51 -56.52 19.28 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.248 -0.907 . . . . 0.0 110.416 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -44.2 65.4 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.265 -0.897 . . . . 0.0 110.494 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.536 HD23 ' CD1' ' A' ' 85' ' ' ILE . 1.1 tt -56.04 -40.89 74.15 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.115 -0.991 . . . . 0.0 110.134 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.465 HG22 ' HG2' ' A' ' 104' ' ' GLN . 38.6 t -68.13 -24.8 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.369 -0.832 . . . . 0.0 110.031 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -75.81 -51.66 12.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.351 -0.843 . . . . 0.0 110.385 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -35.13 21.52 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 0.0 110.667 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.459 HD13 HG22 ' A' ' 85' ' ' ILE . 0.9 OUTLIER -84.85 -40.83 16.65 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.425 -179.75 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -105.16 95.8 6.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.247 -0.908 . . . . 0.0 110.279 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -153.91 -77.61 0.11 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.301 -0.874 . . . . 0.0 110.337 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 138' ' ' ASP . 0.0 OUTLIER -172.25 -152.13 0.07 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.294 -0.879 . . . . 0.0 110.225 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.471 ' HB2' ' O ' ' A' ' 137' ' ' GLU . 22.0 m-20 57.17 157.19 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.43 -0.793 . . . . 0.0 110.361 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER 38.52 29.83 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.456 -0.778 . . . . 0.0 110.707 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.465 ' N ' ' O ' ' A' ' 138' ' ' ASP . 0.9 OUTLIER 43.56 -167.81 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.337 -0.852 . . . . 0.0 110.174 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -84.89 -16.28 41.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.2 -0.937 . . . . 0.0 110.265 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -151.96 -52.83 0.12 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.163 -0.961 . . . . 0.0 110.271 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 49.51 60.8 3.52 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.225 -0.922 . . . . 0.0 110.182 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.414 ' O ' ' HG3' ' A' ' 144' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.218 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' SER . . . . . 0.421 ' O ' ' OG ' ' A' ' -2' ' ' SER . 0.3 OUTLIER 61.05 29.04 18.72 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.221 -1.164 . . . . 0.0 110.224 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.06 79.48 3.58 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.176 -0.952 . . . . 0.0 110.177 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.02 92.58 0.95 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.276 -0.89 . . . . 0.0 110.247 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 ttt -86.17 135.44 33.58 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.218 -0.926 . . . . 0.0 110.251 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.63 159.1 42.95 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.307 -0.871 . . . . 0.0 110.156 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.2 p -104.82 68.66 0.84 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.195 -0.941 . . . . 0.0 110.18 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.402 ' O ' ' C ' ' A' ' 5' ' ' SER . 0.1 OUTLIER -174.23 29.78 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.372 -0.83 . . . . 0.0 110.17 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 6' ' ' LEU . 9.9 m -44.56 157.24 0.07 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.167 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.411 ' CB ' ' O ' ' A' ' 5' ' ' SER . 5.7 tp 62.91 112.91 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.278 -0.889 . . . . 0.0 110.205 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.24 -154.21 0.54 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.185 -0.947 . . . . 0.0 110.17 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.8 ptt-85 -87.78 -167.08 1.76 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.221 -0.925 . . . . 0.0 110.215 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.65 134.6 50.15 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.301 -0.874 . . . . 0.0 110.17 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 21.6 mtp -105.88 -179.76 4.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.249 -0.907 . . . . 0.0 110.184 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mmtt -62.78 -14.76 48.91 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.903 . . . . 0.0 110.051 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.14 132.2 51.66 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.26 -0.9 . . . . 0.0 110.188 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.417 HG23 HD13 ' A' ' 13' ' ' ILE . 70.9 mt -71.37 130.14 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.283 -0.885 . . . . 0.0 110.162 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 4.8 t -95.66 173.62 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.277 -0.89 . . . . 0.0 110.228 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -68.69 109.31 3.75 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.225 -0.922 . . . . 0.0 110.407 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -107.93 115.52 30.28 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.328 -0.857 . . . . 0.0 110.163 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -70.52 149.01 47.59 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.26 -0.9 . . . . 0.0 110.343 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.82 -14.79 43.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.209 -0.932 . . . . 0.0 110.028 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 51.52 22.64 1.59 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.344 -0.848 . . . . 0.0 110.376 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.537 ' CB ' HD12 ' A' ' 46' ' ' LEU . . . -65.93 -46.14 79.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.178 -0.951 . . . . 0.0 110.067 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.438 ' HG3' HG13 ' A' ' 22' ' ' ILE . 12.8 pt-20 -51.97 -28.81 18.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.158 -0.964 . . . . 0.0 110.014 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.438 HG13 ' HG3' ' A' ' 21' ' ' GLU . 64.4 mt -79.34 -47.32 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.292 -0.88 . . . . 0.0 109.992 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.474 ' HB3' HG13 ' A' ' 43' ' ' ILE . 1.8 ttmt -57.91 -30.13 65.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.313 -0.867 . . . . 0.0 110.112 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.523 HG22 HG23 ' A' ' 56' ' ' ILE . 42.4 t -78.96 -41.71 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 109.949 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.491 ' HG2' ' NH1' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -55.59 -42.75 75.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.293 -0.88 . . . . 0.0 109.971 179.88 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -76.21 -30.48 58.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.332 -0.855 . . . . 0.0 110.048 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.505 ' CB ' HD23 ' A' ' 39' ' ' LEU . . . -66.05 -16.03 63.57 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.26 -0.9 . . . . 0.0 110.014 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.479 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 80.7 p -107.89 1.47 22.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.242 -0.911 . . . . 0.0 110.137 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 87.9 p -152.92 60.1 0.79 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.276 -0.89 . . . . 0.0 110.272 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -87.13 170.88 11.12 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 110.161 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -77.96 156.49 79.69 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.913 . . . . 0.0 110.119 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.426 ' O ' ' HB2' ' A' ' 33' ' ' TRP . 12.1 Cg_endo -61.88 -160.86 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.034 1.544 . . . . 0.0 110.282 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.426 ' HB2' ' O ' ' A' ' 32' ' ' PRO . 2.4 m95 62.54 -87.96 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.081 -1.012 . . . . 0.0 110.552 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -138.49 100.28 0.29 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -55.27 -165.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 124.034 1.544 . . . . 0.0 110.476 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.75 93.52 8.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.227 -0.921 . . . . 0.0 110.229 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.98 -24.29 66.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.26 -0.9 . . . . 0.0 110.203 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 11.8 t -98.43 42.55 1.09 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.347 -0.846 . . . . 0.0 110.165 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.505 HD23 ' CB ' ' A' ' 27' ' ' ALA . 0.5 OUTLIER -127.09 -31.19 2.62 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.327 -0.858 . . . . 0.0 110.224 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -58.01 4.0 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.223 -0.923 . . . . 0.0 110.15 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.431 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.9 OUTLIER -44.64 -35.19 2.49 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.321 -0.862 . . . . 0.0 110.168 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.461 ' HB3' ' HD3' ' A' ' 23' ' ' LYS . 29.5 mt-10 -68.4 -56.75 7.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 110.11 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.506 HG21 ' CD2' ' A' ' 84' ' ' LEU . 5.8 mt -48.64 -35.01 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.0 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.538 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . . . -69.75 -51.7 31.79 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.204 -0.935 . . . . 0.0 109.776 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -51.59 -21.74 2.79 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.045 -1.034 . . . . 0.0 109.114 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.537 HD12 ' CB ' ' A' ' 20' ' ' ALA . 21.4 mt -81.35 -38.48 26.58 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.557 -0.715 . . . . 0.0 110.168 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.534 HG22 ' CG2' ' A' ' 92' ' ' VAL . 77.3 p -51.07 -42.39 60.54 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.201 -0.937 . . . . 0.0 109.453 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.514 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 74.9 m-85 -43.82 -45.74 7.5 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.732 -0.787 . . . . 0.0 109.191 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.456 ' O ' ' O ' ' A' ' 48' ' ' TYR . 2.1 t-20 -56.61 -159.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.816 0.817 . . . . 0.0 110.32 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.1 t -124.76 -32.9 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-O 121.52 0.676 . . . . 0.0 109.4 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.574 HG12 ' N ' ' A' ' 52' ' ' ALA . 13.1 t -84.6 -72.72 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 CA-C-O 122.059 0.933 . . . . 0.0 109.816 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.574 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -39.14 -41.02 0.78 Allowed 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.482 -178.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.512 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 27.3 t80 -55.56 -53.78 52.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.467 -0.771 . . . . 0.0 109.839 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.72 -27.22 67.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.284 -0.885 . . . . 0.0 109.985 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -82.98 -19.39 37.17 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.286 -0.884 . . . . 0.0 110.018 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.523 HG23 HG22 ' A' ' 24' ' ' VAL . 11.2 mt -82.09 -68.8 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.694 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.405 ' HE1' ' HB3' ' A' ' 57' ' ' MET . 94.3 mmm -47.27 -34.82 7.03 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.297 -0.877 . . . . 0.0 109.484 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.09 -62.53 1.75 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.432 -0.792 . . . . 0.0 109.85 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.516 ' CB ' HG11 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -57.4 -20.18 28.2 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.268 -0.895 . . . . 0.0 109.763 179.532 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.562 HG21 HD13 ' A' ' 64' ' ' LEU . 0.4 OUTLIER -77.99 -32.99 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.815 . . . . 0.0 109.987 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.564 ' CH2' ' HE2' ' A' ' 81' ' ' MET . 20.4 m95 -76.43 -43.66 39.18 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.905 . . . . 0.0 110.267 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.47 -54.51 46.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.338 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.491 ' NH1' ' HG2' ' A' ' 25' ' ' ARG . 8.4 mtt-85 -69.04 -14.15 62.86 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.23 -0.919 . . . . 0.0 110.184 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.68 HD21 HD13 ' A' ' 106' ' ' LEU . 4.2 mt -77.87 -24.82 48.41 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.215 -0.928 . . . . 0.0 110.189 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.491 ' O ' ' O ' ' A' ' 66' ' ' ASP . 1.5 m-20 -114.62 45.07 1.62 Allowed 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.417 -0.802 . . . . 0.0 109.806 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.491 ' O ' ' O ' ' A' ' 65' ' ' ASN . 9.5 p-10 -56.22 -154.97 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.546 -0.721 . . . . 0.0 110.434 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -123.79 179.89 4.64 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.15 -0.969 . . . . 0.0 110.538 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.548 ' HA3' ' CD2' ' A' ' 111' ' ' TYR . . . -49.46 -36.03 22.92 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.666 -1.373 . . . . 0.0 109.666 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.502 ' C ' ' O ' ' A' ' 68' ' ' GLY . 1.6 tptp -28.77 -70.79 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.979 0 O-C-N 122.312 -0.522 . . . . 0.0 111.439 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.451 ' O ' ' OD2' ' A' ' 66' ' ' ASP . 7.3 m-20 -153.1 108.04 3.19 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.285 -0.885 . . . . 0.0 110.639 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.47 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 25.1 p-90 -66.57 -7.07 17.65 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.372 -0.83 . . . . 0.0 110.043 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.3 -47.49 36.47 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.092 -1.005 . . . . 0.0 109.983 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.454 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -52.27 -40.15 61.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.235 -0.916 . . . . 0.0 109.984 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.612 ' CG1' ' CG2' ' A' ' 123' ' ' VAL . 49.5 t -63.09 -57.6 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.421 -0.799 . . . . 0.0 110.25 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.582 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 11.2 t80 -44.76 -55.7 5.1 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.456 -0.777 . . . . 0.0 110.161 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.479 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 12.3 mmtt -61.71 -31.43 71.58 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.239 -0.913 . . . . 0.0 110.069 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.562 ' HB3' HD23 ' A' ' 64' ' ' LEU . . . -66.98 -24.4 66.04 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.243 -0.91 . . . . 0.0 109.754 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.539 ' HE2' ' CG2' ' A' ' 123' ' ' VAL . 0.3 OUTLIER -79.44 -31.4 42.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.359 -0.838 . . . . 0.0 110.144 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 93.5 m -68.58 -35.33 77.23 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.253 -0.904 . . . . 0.0 110.328 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.523 ' CD2' HD12 ' A' ' 60' ' ' ILE . 30.9 tp -73.25 -36.66 66.42 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.206 -0.934 . . . . 0.0 109.764 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.564 ' HE2' ' CH2' ' A' ' 61' ' ' TRP . 3.6 ttp -71.0 -34.75 71.67 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.167 -0.958 . . . . 0.0 109.823 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.465 ' HB2' HD12 ' A' ' 130' ' ' LEU . 16.4 tt0 -75.72 -36.14 60.05 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.319 -0.863 . . . . 0.0 110.81 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.52 ' CE1' HG23 ' A' ' 87' ' ' THR . 54.0 t80 -72.18 -42.77 65.49 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.168 -0.957 . . . . 0.0 110.455 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.538 ' CD2' ' HA ' ' A' ' 44' ' ' ALA . 53.8 mt -71.42 -29.1 64.5 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.154 -0.966 . . . . 0.0 110.304 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.538 ' CD1' ' O ' ' A' ' 81' ' ' MET . 22.6 mt -64.0 -23.17 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.115 -0.991 . . . . 0.0 109.883 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -98.98 -69.58 0.76 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.946 . . . . 0.0 110.167 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.52 HG23 ' CE1' ' A' ' 83' ' ' TYR . 14.3 t -84.39 -27.18 27.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.253 -0.904 . . . . 0.0 110.238 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.514 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -48.51 -73.42 0.34 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.462 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 7.2 t 174.35 162.91 0.2 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -1.143 . . . . 0.0 110.199 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -62.27 -12.69 22.0 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.274 -0.891 . . . . 0.0 110.199 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.474 ' NH2' ' HG3' ' A' ' 94' ' ' GLN . 5.9 mmp_? -79.01 -43.05 25.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.259 -0.901 . . . . 0.0 110.265 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.534 ' CG2' HG22 ' A' ' 47' ' ' THR . 82.4 t -60.13 -26.0 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.189 -0.944 . . . . 0.0 109.955 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.82 -31.42 23.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.31 -0.869 . . . . 0.0 109.732 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.474 ' HG3' ' NH2' ' A' ' 91' ' ' ARG . 13.3 mm100 -67.95 -48.69 65.18 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.302 -0.874 . . . . 0.0 109.807 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -59.42 -36.88 76.7 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.34 -0.85 . . . . 0.0 109.585 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.418 ' SG ' HD12 ' A' ' 85' ' ' ILE . 44.5 m -56.96 -42.18 79.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.392 -0.817 . . . . 0.0 109.524 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.0 tttp -68.48 -29.07 67.6 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.461 -0.774 . . . . 0.0 109.679 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -83.64 -14.59 51.55 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.387 -0.821 . . . . 0.0 110.077 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -126.21 39.78 3.87 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.364 -0.835 . . . . 0.0 110.271 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 6.1 ttm -65.5 -30.07 70.8 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.186 -0.947 . . . . 0.0 110.206 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.441 ' O ' ' HB ' ' A' ' 105' ' ' THR . 59.7 m-85 -64.39 -12.59 44.29 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.288 -0.883 . . . . 0.0 110.018 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.438 ' O ' HG21 ' A' ' 105' ' ' THR . . . -90.61 -40.67 11.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 110.224 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.53 HG11 ' CG2' ' A' ' 131' ' ' VAL . 2.4 t -75.94 -21.01 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.322 -0.862 . . . . 0.0 109.911 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -91.53 -26.43 18.77 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.373 -0.83 . . . . 0.0 110.316 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.441 ' HB ' ' O ' ' A' ' 101' ' ' TYR . 9.2 t -65.4 -16.04 63.21 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.91 . . . . 0.0 110.177 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.68 HD13 HD21 ' A' ' 64' ' ' LEU . 15.4 mt -70.58 -39.85 73.62 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.283 -0.886 . . . . 0.0 110.336 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -49.64 -33.98 16.98 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.331 -0.855 . . . . 0.0 110.195 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -86.72 -25.99 24.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.379 -0.825 . . . . 0.0 110.283 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -45.39 107.69 0.1 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.153 -0.967 . . . . 0.0 110.265 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -140.56 161.86 36.73 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.297 -0.877 . . . . 0.0 110.183 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.548 ' CD2' ' HA3' ' A' ' 68' ' ' GLY . 0.7 OUTLIER -165.85 127.61 1.93 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.257 -0.902 . . . . 0.0 110.104 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.46 HG11 ' CA ' ' A' ' 116' ' ' GLY . 46.0 t -148.47 80.7 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.231 -0.918 . . . . 0.0 110.333 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.03 -63.97 1.35 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.341 -0.85 . . . . 0.0 110.065 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.443 ' CG ' ' N ' ' A' ' 115' ' ' ASP . 1.4 ptm85 -72.57 -47.05 51.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.249 -0.907 . . . . 0.0 110.45 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.443 ' N ' ' CG ' ' A' ' 114' ' ' ARG . 0.4 OUTLIER -75.63 -28.35 58.76 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.331 -0.855 . . . . 0.0 110.416 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.46 ' CA ' HG11 ' A' ' 112' ' ' VAL . . . 66.82 13.95 62.26 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -131.69 146.93 52.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.285 -1.126 . . . . 0.0 110.182 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -99.38 114.4 27.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.283 -0.885 . . . . 0.0 110.176 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -133.18 28.79 4.08 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.228 -0.92 . . . . 0.0 110.285 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -91.0 37.46 3.38 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.0 p -81.38 -43.51 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.302 -1.116 . . . . 0.0 110.107 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.9 OUTLIER -50.88 -49.31 59.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.452 -0.78 . . . . 0.0 110.498 -179.838 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.612 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 9.7 p -77.3 -16.0 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.164 -0.96 . . . . 0.0 110.398 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -66.97 0.78 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.197 -0.939 . . . . 0.0 110.599 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.475 ' CG ' ' N ' ' A' ' 126' ' ' LYS . 13.8 pt-20 -60.02 -43.62 95.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.398 -0.814 . . . . 0.0 110.679 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.582 ' HG3' ' CE1' ' A' ' 75' ' ' TYR . 7.4 tmtm? -54.55 -51.64 64.6 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.125 -0.985 . . . . 0.0 110.161 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.465 ' HA ' ' SD ' ' A' ' 78' ' ' MET . . . -53.99 -41.37 67.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.145 -0.972 . . . . 0.0 110.15 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -58.21 -39.93 80.28 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.226 -0.921 . . . . 0.0 110.041 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 126' ' ' LYS . 7.9 mt-30 -57.3 -48.61 78.5 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.305 -0.872 . . . . 0.0 110.174 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.519 HD11 HD11 ' A' ' 85' ' ' ILE . 9.2 tp -57.59 -28.78 63.92 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.172 -0.955 . . . . 0.0 109.677 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.53 ' CG2' HG11 ' A' ' 103' ' ' VAL . 43.1 t -78.29 -27.9 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.343 -0.848 . . . . 0.0 109.513 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.508 ' CB ' ' OD1' ' A' ' 136' ' ' ASP . . . -72.61 -53.35 12.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.461 -0.774 . . . . 0.0 110.252 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.2 mp -56.13 -32.71 64.48 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.231 -0.918 . . . . 0.0 110.176 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.532 ' CD2' HG22 ' A' ' 85' ' ' ILE . 31.4 mt -79.42 -23.69 43.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 0.0 110.192 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -164.38 64.87 0.15 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.24 -0.913 . . . . 0.0 110.122 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.508 ' OD1' ' CB ' ' A' ' 132' ' ' ALA . 0.3 OUTLIER -81.54 -66.37 0.9 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 110.231 -179.82 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.462 ' HB3' ' O ' ' A' ' 136' ' ' ASP . 14.0 tp10 57.33 89.59 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.174 -0.954 . . . . 0.0 110.216 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -102.13 -167.61 1.43 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.323 -0.861 . . . . 0.0 110.251 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -77.68 137.48 38.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.318 -0.864 . . . . 0.0 110.211 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.8 79.22 1.42 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.216 -0.928 . . . . 0.0 110.171 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.61 -86.12 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.199 -0.938 . . . . 0.0 110.189 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -130.51 -175.28 3.6 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 144' ' ' ARG . 7.1 mt-10 -119.32 83.97 2.12 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.294 -0.879 . . . . 0.0 110.279 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.432 ' CB ' ' O ' ' A' ' 143' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.26 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 8.6 t -104.09 162.61 13.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.277 -1.131 . . . . 0.0 110.164 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.52 130.46 50.91 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 0.0 110.205 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -123.55 49.21 1.74 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.33 -0.856 . . . . 0.0 110.291 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.9 tpt -73.56 115.54 13.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 110.242 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.87 115.54 24.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.163 -0.96 . . . . 0.0 110.262 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 36.1 p -89.93 119.0 29.92 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.27 -0.894 . . . . 0.0 110.166 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.1 m -66.86 -160.97 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.29 -0.881 . . . . 0.0 110.118 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.5 m -129.1 165.77 20.58 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.214 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -104.65 34.08 3.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.306 -0.871 . . . . 0.0 110.144 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -102.38 26.75 7.44 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 110.277 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.8 mtt180 -150.44 145.65 26.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.193 -0.942 . . . . 0.0 110.243 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -91.71 166.46 12.77 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.276 -0.89 . . . . 0.0 110.211 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.5 ptt? -90.45 175.07 7.22 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.294 -0.879 . . . . 0.0 110.13 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.98 -166.99 1.74 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 110.199 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -132.44 59.49 1.72 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.9 . . . . 0.0 110.129 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 tt -85.02 -175.1 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.308 -0.87 . . . . 0.0 110.215 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.1 t -75.45 145.84 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.147 -0.971 . . . . 0.0 110.278 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.438 ' O ' ' HB2' ' A' ' 16' ' ' ASN . 36.5 m-70 -120.43 163.39 17.98 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.23 -0.919 . . . . 0.0 110.158 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 15' ' ' HIS . 2.8 t30 -177.26 91.74 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.199 -0.938 . . . . 0.0 110.241 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.532 ' O ' ' CB ' ' A' ' 18' ' ' SER . 1.4 p90 -50.05 171.74 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.234 -0.916 . . . . 0.0 110.193 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.532 ' CB ' ' O ' ' A' ' 17' ' ' TYR . 1.3 m 76.08 -73.33 0.09 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.611 -0.68 . . . . 0.0 110.545 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HG2' ' CD1' ' A' ' 22' ' ' ILE . 38.0 mt-10 51.07 32.01 7.17 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.9 -1.125 . . . . 0.0 110.122 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.434 ' HB3' HD21 ' A' ' 46' ' ' LEU . . . -66.68 -56.54 10.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.265 -0.897 . . . . 0.0 110.221 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.412 ' C ' ' O ' ' A' ' 20' ' ' ALA . 15.1 pt-20 -42.97 -29.55 0.34 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.306 -0.871 . . . . 0.0 110.197 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.529 ' CD1' ' HG2' ' A' ' 19' ' ' GLU . 36.4 mt -79.78 -48.73 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.255 -0.903 . . . . 0.0 110.121 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.462 ' O ' ' HB3' ' A' ' 27' ' ' ALA . 2.6 mmtm -50.46 -35.75 30.34 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 0.0 110.037 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.528 HG23 HG22 ' A' ' 56' ' ' ILE . 98.3 t -72.46 -48.15 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.333 -0.855 . . . . 0.0 110.106 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.71 -51.2 40.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.176 -0.952 . . . . 0.0 110.009 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -65.69 -29.17 69.68 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.936 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.482 ' CB ' ' CD2' ' A' ' 39' ' ' LEU . . . -74.28 -19.51 60.47 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.275 -0.891 . . . . 0.0 110.022 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.528 ' HA ' ' CB ' ' A' ' 76' ' ' LYS . 34.5 p -120.42 62.55 0.85 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.328 -0.858 . . . . 0.0 110.262 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.7 t -174.19 -36.26 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.241 -0.912 . . . . 0.0 110.16 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -153.65 152.42 30.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.267 -0.895 . . . . 0.0 110.263 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.534 ' N ' ' CD ' ' A' ' 32' ' ' PRO . 0.5 OUTLIER -158.4 50.1 0.37 Allowed Pre-proline 0 N--CA 1.492 1.651 0 O-C-N 121.286 -0.884 . . . . 0.0 110.243 179.941 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.534 ' CD ' ' N ' ' A' ' 31' ' ' ASP . 17.8 Cg_endo -65.41 -176.32 0.51 Allowed 'Trans proline' 0 C--N 1.305 -1.732 0 O-C-N 124.012 1.532 . . . . 0.0 110.502 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -91.69 -154.05 0.35 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.348 -0.845 . . . . 0.0 110.733 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 146.57 -177.9 24.59 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -62.52 -64.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 123.985 1.518 . . . . 0.0 110.326 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.54 105.33 6.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.243 -0.91 . . . . 0.0 110.131 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.4 t -89.15 148.03 23.88 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.269 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -172.62 101.2 0.14 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.274 -0.891 . . . . 0.0 110.152 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.482 ' CD2' ' CB ' ' A' ' 27' ' ' ALA . 1.3 tp -139.62 -42.28 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.237 -0.914 . . . . 0.0 110.234 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.439 ' HE2' HG21 ' A' ' 79' ' ' THR . 8.5 mtt -60.03 -51.9 67.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.157 -0.964 . . . . 0.0 110.195 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 98.0 p -52.78 -26.32 13.97 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.201 -0.937 . . . . 0.0 110.141 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 8.3 mm-40 -78.08 -54.99 5.65 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.251 -0.906 . . . . 0.0 110.2 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.522 HG22 ' CD1' ' A' ' 80' ' ' LEU . 54.6 mt -51.83 -38.11 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.187 -0.945 . . . . 0.0 109.998 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.545 ' HB2' HD21 ' A' ' 84' ' ' LEU . . . -68.61 -53.16 24.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.09 -1.006 . . . . 0.0 109.269 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.458 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 4.9 t70 -51.25 -22.06 2.49 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.13 -0.981 . . . . 0.0 109.147 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.477 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 8.5 mt -80.15 -39.72 28.81 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.5 -0.75 . . . . 0.0 110.053 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.543 HG23 HG22 ' A' ' 92' ' ' VAL . 81.7 p -48.54 -38.98 21.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.094 -1.004 . . . . 0.0 109.26 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.585 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 63.3 m-85 -45.28 -49.62 12.45 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.401 -0.92 . . . . 0.0 109.442 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.544 ' O ' ' C ' ' A' ' 50' ' ' VAL . 49.2 m-20 -70.49 92.29 0.82 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.672 -0.642 . . . . 0.0 110.8 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.544 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -12.16 -57.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.21 178.095 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.551 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.6 t -62.54 -64.85 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.07 -1.019 . . . . 0.0 109.888 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.551 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -38.03 -40.98 0.53 Allowed 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.302 0.572 . . . . 0.0 110.568 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.583 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 29.1 t80 -64.81 -57.48 8.77 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.453 -0.779 . . . . 0.0 110.265 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -26.82 9.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.213 -0.929 . . . . 0.0 110.016 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -84.17 -31.72 24.99 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.238 -0.914 . . . . 0.0 109.981 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.528 HG22 HG23 ' A' ' 24' ' ' VAL . 17.0 mt -74.66 -68.48 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.396 -0.815 . . . . 0.0 110.117 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.583 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 14.1 mmm -43.8 -38.83 3.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.267 -0.896 . . . . 0.0 109.729 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.83 -59.87 3.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.394 -0.816 . . . . 0.0 109.951 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 16.4 mmt -60.11 -21.94 62.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.263 -0.898 . . . . 0.0 109.896 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.522 HD11 HD21 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -76.92 -28.28 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.425 -0.797 . . . . 0.0 109.878 179.898 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 14.4 m95 -81.99 -29.54 32.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.276 -0.89 . . . . 0.0 110.373 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -58.54 3.4 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.378 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -64.57 -24.02 67.46 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.185 -0.947 . . . . 0.0 110.139 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.594 HD21 ' CD1' ' A' ' 106' ' ' LEU . 5.6 mt -66.14 -16.28 63.83 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.0 110.392 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.473 ' O ' ' O ' ' A' ' 66' ' ' ASP . 22.9 m-20 -113.59 43.48 1.77 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.293 -0.879 . . . . 0.0 110.058 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.473 ' O ' ' O ' ' A' ' 65' ' ' ASN . 0.1 OUTLIER -53.82 -166.78 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.374 -0.829 . . . . 0.0 110.297 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.426 ' O ' ' C ' ' A' ' 68' ' ' GLY . 0.2 OUTLIER -151.32 -169.45 3.38 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 110.474 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.426 ' C ' ' O ' ' A' ' 67' ' ' HIS . . . 42.49 -128.75 4.86 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.55 16.7 19.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.397 -1.061 . . . . 0.0 110.207 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -86.44 35.74 0.67 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.323 -0.86 . . . . 0.0 110.376 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.428 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 19.6 p-90 -63.3 -10.31 15.63 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.251 -0.906 . . . . 0.0 110.381 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 39.2 mtt85 -48.93 -46.21 42.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.107 -0.996 . . . . 0.0 110.092 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 -58.73 -48.88 79.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.227 -0.92 . . . . 0.0 110.107 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.538 ' CG1' HG13 ' A' ' 123' ' ' VAL . 16.9 t -46.62 -44.72 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.269 -0.895 . . . . 0.0 110.181 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.489 ' O ' ' SD ' ' A' ' 78' ' ' MET . 4.0 t80 -55.72 -54.87 39.02 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.251 -0.906 . . . . 0.0 110.283 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.528 ' CB ' ' HA ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -71.17 -9.11 57.52 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.898 -1.126 . . . . 0.0 109.52 179.525 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.555 ' HB3' ' CD2' ' A' ' 64' ' ' LEU . . . -79.16 -70.2 0.52 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.395 -0.815 . . . . 0.0 110.941 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.544 ' CE ' HG11 ' A' ' 123' ' ' VAL . 0.7 OUTLIER -56.63 -26.7 56.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.114 -0.991 . . . . 0.0 110.105 -179.487 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.44 ' OG1' ' O ' ' A' ' 75' ' ' TYR . 61.2 m -63.65 -65.2 0.71 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.031 -1.043 . . . . 0.0 109.439 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.552 HD11 ' CD2' ' A' ' 84' ' ' LEU . 10.6 tp -42.67 -59.0 2.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.502 -0.748 . . . . 0.0 109.316 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.476 ' O ' HG13 ' A' ' 85' ' ' ILE . 19.4 ttt -42.9 -46.08 5.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.359 -0.838 . . . . 0.0 109.836 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.52 ' CA ' HD13 ' A' ' 130' ' ' LEU . 40.8 tt0 -58.81 -48.57 80.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.356 -0.84 . . . . 0.0 109.779 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.444 ' HB3' HD23 ' A' ' 84' ' ' LEU . 22.9 t80 -54.48 -37.39 65.2 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.41 -0.806 . . . . 0.0 110.183 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.552 ' CD2' HD11 ' A' ' 80' ' ' LEU . 2.6 mt -74.67 -28.45 60.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.273 -0.892 . . . . 0.0 110.007 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.533 ' CD1' HD21 ' A' ' 130' ' ' LEU . 32.2 mt -70.22 -26.05 28.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.037 -1.039 . . . . 0.0 109.962 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -88.77 -68.68 0.75 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.261 -0.9 . . . . 0.0 110.383 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.454 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 14.5 t -95.1 -22.73 17.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.201 -0.937 . . . . 0.0 110.49 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.585 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -47.68 -77.17 0.12 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.466 ' HB3' ' O ' ' A' ' 88' ' ' GLY . 6.2 p -178.71 171.45 1.48 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.169 -1.195 . . . . 0.0 110.301 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -71.47 -13.8 61.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.272 -0.892 . . . . 0.0 110.219 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 15.7 mmt180 -79.48 -41.51 27.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.25 -0.906 . . . . 0.0 109.989 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.577 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 93.3 t -56.26 -33.24 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.263 -0.898 . . . . 0.0 109.865 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.455 ' O ' ' HB3' ' A' ' 96' ' ' CYS . 1.6 t -76.15 -40.97 51.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.289 -0.882 . . . . 0.0 109.849 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -57.18 -56.58 19.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -0.869 . . . . 0.0 109.861 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -52.92 -38.75 62.22 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.361 -0.837 . . . . 0.0 109.568 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.455 ' HB3' ' O ' ' A' ' 93' ' ' SER . 48.9 t -54.67 -43.84 72.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.359 -0.838 . . . . 0.0 109.693 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -65.44 -35.81 82.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.352 -0.842 . . . . 0.0 109.675 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -78.24 -12.68 60.01 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.421 -0.799 . . . . 0.0 109.842 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -134.04 30.41 3.65 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.458 -0.776 . . . . 0.0 110.119 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 4.9 ptt? -62.99 -24.92 68.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.178 -0.951 . . . . 0.0 110.009 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.46 ' O ' ' HB ' ' A' ' 105' ' ' THR . 2.7 m-85 -65.76 -23.84 66.82 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.213 -0.929 . . . . 0.0 109.99 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.519 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -78.37 -40.89 34.91 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.381 -0.825 . . . . 0.0 110.193 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.46 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 5.3 t -72.17 -27.64 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.306 -0.871 . . . . 0.0 110.151 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -86.84 -29.36 22.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.327 -0.858 . . . . 0.0 110.372 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.519 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 11.0 t -57.59 -19.38 25.45 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.236 -0.915 . . . . 0.0 110.232 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.594 ' CD1' HD21 ' A' ' 64' ' ' LEU . 20.4 mt -68.97 -40.65 78.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.251 -0.906 . . . . 0.0 110.255 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 14.9 ttpp -52.64 -20.67 3.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.235 -0.916 . . . . 0.0 110.196 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -103.1 -26.47 13.03 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.27 -0.894 . . . . 0.0 110.364 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.41 115.93 6.18 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.232 -0.917 . . . . 0.0 110.342 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -158.43 137.31 11.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 110.144 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.451 ' O ' HG23 ' A' ' 112' ' ' VAL . 2.7 t80 -115.54 137.08 52.43 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.348 -0.845 . . . . 0.0 110.128 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.491 ' O ' ' CG1' ' A' ' 112' ' ' VAL . 69.3 t -147.76 18.44 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.243 -0.911 . . . . 0.0 110.227 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.43 -169.29 0.11 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.254 -0.903 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.22 -47.53 62.3 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.257 -0.902 . . . . 0.0 110.234 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -149.58 132.74 16.34 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.301 -0.874 . . . . 0.0 110.179 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.42 ' C ' ' CG1' ' A' ' 112' ' ' VAL . . . 175.19 -146.43 8.36 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.3 ptmm? -139.44 158.37 44.25 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.236 -1.155 . . . . 0.0 110.287 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -45.68 144.41 1.67 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.212 -0.93 . . . . 0.0 110.305 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.407 ' HA ' ' OE1' ' A' ' 119' ' ' GLN . 7.8 mm100 -92.59 -48.8 6.43 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.278 -0.889 . . . . 0.0 110.208 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -135.79 99.88 0.33 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.564 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.2 p -79.88 -42.14 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.317 -1.108 . . . . 0.0 110.071 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.564 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.6 m-80 -36.6 -30.11 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.218 0.533 . . . . 0.0 110.64 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.544 HG11 ' CE ' ' A' ' 78' ' ' MET . 12.6 t -72.7 -62.12 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.339 -0.851 . . . . 0.0 110.283 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -44.47 -43.82 8.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.251 -0.905 . . . . 0.0 110.658 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.525 ' HG3' ' N ' ' A' ' 126' ' ' LYS . 10.0 pt-20 -75.39 -32.22 60.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.276 -0.89 . . . . 0.0 110.717 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.525 ' N ' ' HG3' ' A' ' 125' ' ' GLU . 33.4 tptt -62.07 -52.89 62.08 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.97 -1.081 . . . . 0.0 110.247 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.46 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -58.26 -41.42 84.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.302 -0.874 . . . . 0.0 110.267 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 11.6 tttm -59.67 -38.29 81.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.23 -0.919 . . . . 0.0 110.305 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -62.32 -40.62 96.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.281 -0.887 . . . . 0.0 110.6 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.533 HD21 ' CD1' ' A' ' 85' ' ' ILE . 7.9 tt -61.17 -40.39 93.71 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.08 -1.012 . . . . 0.0 110.508 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.411 HG21 HG12 ' A' ' 103' ' ' VAL . 54.0 t -77.45 -24.96 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.321 -0.862 . . . . 0.0 110.475 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.0 -52.61 18.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.234 -0.916 . . . . 0.0 110.573 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.491 ' C ' ' CD1' ' A' ' 133' ' ' LEU . 3.5 pp -66.31 -22.16 66.28 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.181 -0.95 . . . . 0.0 110.371 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.528 HD12 ' CG2' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -83.02 -69.22 0.64 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.268 -0.895 . . . . 0.0 110.466 -179.777 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.441 ' O ' ' CD ' ' A' ' 135' ' ' ARG . 0.1 OUTLIER -88.51 49.56 1.81 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.185 -0.947 . . . . 0.0 110.226 -179.913 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -82.11 -16.92 48.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.244 -0.91 . . . . 0.0 110.323 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.78 119.92 5.15 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.194 -0.941 . . . . 0.0 110.216 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -169.55 40.69 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.231 -0.918 . . . . 0.0 110.384 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.9 ttm105 -102.54 80.53 1.94 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.178 -0.951 . . . . 0.0 110.333 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -132.42 13.01 4.57 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.28 -0.887 . . . . 0.0 110.2 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.86 109.58 3.46 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.248 -0.908 . . . . 0.0 110.154 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -109.77 27.49 9.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.272 -0.892 . . . . 0.0 110.269 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -138.65 -171.43 3.06 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.244 -0.91 . . . . 0.0 110.193 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.169 -0.957 . . . . 0.0 110.224 -179.999 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' SER . . . . . 0.409 ' O ' ' CB ' ' A' ' -1' ' ' SER . 0.5 OUTLIER -147.08 60.75 1.18 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.319 -1.106 . . . . 0.0 110.092 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' SER . . . . . 0.409 ' CB ' ' O ' ' A' ' -2' ' ' SER . 1.2 m 63.45 153.52 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.251 -0.906 . . . . 0.0 110.087 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 15.8 mmt-85 -142.77 -42.11 0.32 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 110.307 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.8 ttm -58.1 136.29 57.17 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.161 -0.962 . . . . 0.0 110.209 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.3 m -153.19 -87.48 0.06 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.347 -0.846 . . . . 0.0 110.17 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 p -113.34 146.84 38.78 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.921 . . . . 0.0 110.176 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.17 42.26 1.1 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.044 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.437 ' O ' ' O ' ' A' ' 6' ' ' LEU . 13.4 m -122.12 -163.15 1.05 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.337 -0.852 . . . . 0.0 110.216 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.437 ' O ' ' O ' ' A' ' 5' ' ' SER . 7.5 tt 51.03 100.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.211 -0.931 . . . . 0.0 110.299 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.407 ' O ' HD23 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -61.32 175.92 0.52 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.286 -0.884 . . . . 0.0 110.223 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.21 -36.36 1.31 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.194 -0.941 . . . . 0.0 110.272 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.0 107.17 0.59 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.154 -0.966 . . . . 0.0 110.27 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -89.61 -153.86 0.29 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.243 -0.91 . . . . 0.0 110.275 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.1 mtpt -69.17 -52.94 22.97 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.277 -0.89 . . . . 0.0 110.145 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -149.38 -161.91 1.44 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -0.91 . . . . 0.0 110.139 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.468 ' CD1' ' N ' ' A' ' 13' ' ' ILE . 5.2 mp -135.06 173.36 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.167 -0.958 . . . . 0.0 110.205 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 m -116.25 165.87 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.22 -0.925 . . . . 0.0 110.227 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -136.11 -178.97 5.39 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -0.907 . . . . 0.0 110.302 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -137.64 80.72 1.82 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.289 -0.882 . . . . 0.0 110.048 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.557 ' CD2' ' HB2' ' A' ' 18' ' ' SER . 32.4 p90 -58.3 -163.28 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 0.0 110.184 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.557 ' HB2' ' CD2' ' A' ' 17' ' ' TYR . 1.1 t 64.29 54.04 1.64 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.191 -0.943 . . . . 0.0 110.165 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -126.56 5.96 6.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.313 -0.867 . . . . 0.0 110.149 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.513 ' CB ' HD11 ' A' ' 46' ' ' LEU . . . -60.42 -45.58 93.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.266 -0.896 . . . . 0.0 110.286 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.459 ' HG3' HG13 ' A' ' 22' ' ' ILE . 9.4 pt-20 -43.39 -40.94 3.93 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 110.051 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.524 HG21 HD13 ' A' ' 22' ' ' ILE . 37.3 mt -69.45 -40.46 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.2 -0.938 . . . . 0.0 109.968 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.53 -61.72 2.41 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.287 -0.883 . . . . 0.0 110.122 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.523 HG22 HG23 ' A' ' 56' ' ' ILE . 84.2 t -48.35 -33.33 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.241 -0.912 . . . . 0.0 110.052 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.402 ' HB3' ' O ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER -64.6 -46.39 82.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.374 -0.829 . . . . 0.0 110.244 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.01 -17.13 61.03 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.384 -0.822 . . . . 0.0 110.19 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.553 ' CB ' ' CD2' ' A' ' 39' ' ' LEU . . . -79.7 -28.1 40.67 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 110.152 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.41 HG23 ' HA ' ' A' ' 77' ' ' ALA . 77.4 p -118.36 45.26 2.05 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.24 -0.912 . . . . 0.0 110.142 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.4 t -168.69 36.48 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.255 -0.903 . . . . 0.0 110.145 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -164.09 146.06 8.98 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.234 -0.916 . . . . 0.0 110.068 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.11 148.26 77.99 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.218 -0.926 . . . . 0.0 110.267 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.82 -161.63 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 124.014 1.534 . . . . 0.0 110.287 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.3 m95 63.03 171.24 0.15 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.222 -0.924 . . . . 0.0 110.44 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.422 ' O ' ' O ' ' A' ' 35' ' ' PRO . . . 85.17 -176.39 50.31 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.529 -1.429 . . . . 0.0 109.529 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.449 ' O ' ' CB ' ' A' ' 36' ' ' SER . 23.7 Cg_exo -59.06 -143.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.664 0 O-C-N 124.016 1.535 . . . . 0.0 110.397 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.449 ' CB ' ' O ' ' A' ' 35' ' ' PRO . 0.1 OUTLIER 66.27 108.19 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.355 -0.841 . . . . 0.0 110.162 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.9 t -63.72 -78.45 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.218 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.5 m -149.89 108.57 3.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.148 -0.97 . . . . 0.0 110.243 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.553 ' CD2' ' CB ' ' A' ' 27' ' ' ALA . 0.5 OUTLIER -83.96 -25.18 30.26 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.935 . . . . 0.0 110.18 179.901 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.0 mtp -66.99 -52.36 43.57 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.275 -0.891 . . . . 0.0 110.149 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 t -55.04 -32.08 61.6 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.269 -0.894 . . . . 0.0 110.221 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.94 -46.4 52.7 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.257 -0.902 . . . . 0.0 110.218 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.459 ' O ' ' HB2' ' A' ' 46' ' ' LEU . 68.6 mt -59.81 -31.01 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.129 -0.982 . . . . 0.0 109.853 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.552 ' HB1' HD21 ' A' ' 84' ' ' LEU . . . -70.65 -51.43 27.94 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.135 -0.978 . . . . 0.0 109.434 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.406 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 38.4 t0 -52.68 -21.08 3.6 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.076 -1.015 . . . . 0.0 108.886 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.525 ' O ' ' CB ' ' A' ' 52' ' ' ALA . 15.5 mt -79.81 -38.31 33.23 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.488 -0.757 . . . . 0.0 110.247 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.518 ' HA ' ' CA ' ' A' ' 53' ' ' PHE . 55.3 p -52.49 -45.41 66.15 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.946 -1.096 . . . . 0.0 109.063 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.463 ' OH ' ' O ' ' A' ' 87' ' ' THR . 90.4 m-85 -43.58 -41.98 4.84 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.38 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.535 ' O ' ' N ' ' A' ' 51' ' ' VAL . 0.3 OUTLIER -73.51 91.43 1.81 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.577 -0.702 . . . . 0.0 110.183 179.531 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.532 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.09 -59.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.571 178.309 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.556 HG11 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -65.05 -65.78 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.104 -0.998 . . . . 0.0 110.203 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.556 ' N ' HG11 ' A' ' 51' ' ' VAL . . . -35.64 -46.56 0.43 Allowed 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.099 -177.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.518 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 4.7 t80 -55.4 -56.75 16.58 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.279 -0.888 . . . . 0.0 110.289 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 58' ' ' SER . 88.9 p -52.1 -38.88 58.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.206 -0.934 . . . . 0.0 110.245 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -70.14 -29.73 66.73 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.431 -0.793 . . . . 0.0 110.39 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.523 HG23 HG22 ' A' ' 24' ' ' VAL . 11.2 mt -77.55 -70.28 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.187 -0.946 . . . . 0.0 110.281 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.516 ' HG3' ' NE1' ' A' ' 61' ' ' TRP . 1.9 tpt -47.19 -34.6 6.48 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.144 -0.972 . . . . 0.0 110.031 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.46 ' HB2' ' O ' ' A' ' 54' ' ' SER . 32.5 t -57.23 -61.82 2.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.333 -0.854 . . . . 0.0 110.108 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.4 mmt -58.21 -26.62 63.06 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.199 -0.938 . . . . 0.0 109.941 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.567 HG23 HD13 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -71.6 -31.07 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.299 -0.876 . . . . 0.0 109.88 179.747 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.516 ' NE1' ' HG3' ' A' ' 57' ' ' MET . 11.0 m95 -77.47 -42.93 34.07 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.277 -0.889 . . . . 0.0 110.386 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -60.5 3.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.283 -0.886 . . . . 0.0 110.605 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -13.04 57.96 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.187 -0.946 . . . . 0.0 110.578 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.607 HD21 ' CD1' ' A' ' 106' ' ' LEU . 2.4 mt -74.99 -13.43 60.51 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.162 -0.961 . . . . 0.0 110.576 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -108.3 38.99 2.07 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.15 -0.969 . . . . 0.0 110.379 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.524 ' OD2' ' CB ' ' A' ' 73' ' ' HIS . 75.8 m-20 -50.95 136.51 22.75 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.179 -0.951 . . . . 0.0 110.048 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.464 ' O ' ' O ' ' A' ' 66' ' ' ASP . 4.9 m-70 -53.08 -169.39 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.587 -0.696 . . . . 0.0 110.177 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.52 ' HA3' ' CD2' ' A' ' 111' ' ' TYR . . . -86.08 58.96 4.74 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 28.8 mttp -150.96 -81.9 0.1 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.378 -1.072 . . . . 0.0 110.148 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -84.77 73.93 10.54 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.285 -0.884 . . . . 0.0 110.511 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.462 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 33.7 p-90 -71.44 -13.64 61.9 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.24 -0.912 . . . . 0.0 110.096 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.444 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 14.9 mtt180 -50.69 -42.98 57.46 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.242 -0.911 . . . . 0.0 109.945 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.524 ' CB ' ' OD2' ' A' ' 66' ' ' ASP . 1.3 m170 -54.56 -39.62 67.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.321 -0.862 . . . . 0.0 109.835 179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.535 ' CG1' HG12 ' A' ' 123' ' ' VAL . 42.7 t -60.64 -51.27 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.314 -0.866 . . . . 0.0 109.759 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 74' ' ' VAL . 2.2 t80 -41.79 -61.55 1.08 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.393 -0.817 . . . . 0.0 110.261 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.03 -28.98 70.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.271 -0.893 . . . . 0.0 110.195 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.551 ' HB3' HD23 ' A' ' 64' ' ' LEU . . . -61.24 -70.32 0.19 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.185 -0.947 . . . . 0.0 110.166 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.525 ' CE ' HG13 ' A' ' 123' ' ' VAL . 3.0 ptp -50.49 -26.61 5.33 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.398 -0.814 . . . . 0.0 110.023 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 75' ' ' TYR . 61.2 m -66.68 -47.27 72.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.272 -0.892 . . . . 0.0 109.937 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.53 HD23 HD11 ' A' ' 60' ' ' ILE . 16.6 tp -64.22 -29.7 70.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.428 -0.795 . . . . 0.0 109.838 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.504 ' O ' ' CG1' ' A' ' 85' ' ' ILE . 5.2 ttp -71.86 -35.17 69.74 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.333 -0.854 . . . . 0.0 109.893 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.469 ' HB2' HD12 ' A' ' 130' ' ' LEU . 46.2 tt0 -70.87 -56.41 6.34 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.298 -0.876 . . . . 0.0 110.22 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -52.56 -45.06 66.25 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.289 -0.882 . . . . 0.0 110.74 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.552 HD21 ' HB1' ' A' ' 44' ' ' ALA . 59.8 mt -73.0 -29.68 63.21 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.935 . . . . 0.0 110.791 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.557 HG23 ' CD2' ' A' ' 134' ' ' LEU . 8.5 mt -61.19 -14.28 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 120.859 -1.151 . . . . 0.0 109.635 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 43.0 mttt -107.03 -77.76 0.59 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.241 -0.912 . . . . 0.0 109.97 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.463 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 13.5 t -82.49 2.88 30.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.881 . . . . 0.0 110.019 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.557 ' O ' ' CB ' ' A' ' 89' ' ' SER . . . -93.39 30.06 7.66 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.2 OUTLIER 75.74 148.59 0.1 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.58 -0.953 . . . . 0.0 110.41 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.3 -9.72 13.01 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.48 -0.763 . . . . 0.0 110.542 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 -71.46 -43.13 67.19 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.184 -0.948 . . . . 0.0 109.836 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.545 ' CG2' ' O ' ' A' ' 88' ' ' GLY . 99.3 t -55.98 -32.85 34.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.481 -0.762 . . . . 0.0 110.324 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.446 ' HA ' HG12 ' A' ' 85' ' ' ILE . 1.1 t -81.56 -41.81 21.05 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.239 -0.913 . . . . 0.0 110.27 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -55.12 -54.18 46.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.0 109.961 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.442 ' HG2' ' HE2' ' A' ' 57' ' ' MET . 11.1 tt0 -54.18 -39.46 66.62 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.408 -0.807 . . . . 0.0 109.657 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.465 ' SG ' ' CD1' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -55.26 -43.01 74.27 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.318 -0.864 . . . . 0.0 109.644 179.527 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -68.12 -31.22 70.66 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.435 -0.791 . . . . 0.0 109.704 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -75.62 -19.84 58.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.432 -0.793 . . . . 0.0 109.798 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -122.07 40.67 3.59 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.411 -0.806 . . . . 0.0 110.033 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.468 ' O ' ' HB2' ' A' ' 104' ' ' GLN . 0.2 OUTLIER -56.15 -22.64 29.92 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.27 -0.894 . . . . 0.0 110.343 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.431 ' N ' ' HG2' ' A' ' 100' ' ' MET . 2.3 m-30 -76.57 -32.26 58.06 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -0.916 . . . . 0.0 110.256 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.529 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -74.5 -39.41 62.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 110.219 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.568 ' CG1' ' N ' ' A' ' 104' ' ' GLN . 3.2 p -74.26 -42.43 50.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 O-C-N 121.287 -0.883 . . . . 0.0 109.304 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.568 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 67.3 mt-30 -71.94 -20.16 61.8 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.596 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.529 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 5.1 t -53.34 -28.28 27.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.951 -1.093 . . . . 0.0 110.056 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.607 ' CD1' HD21 ' A' ' 64' ' ' LEU . 75.5 mt -71.94 -35.32 69.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.874 . . . . 0.0 110.263 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.452 ' HA ' ' HG2' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -53.98 -25.94 23.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.234 -0.916 . . . . 0.0 110.087 179.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.457 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 53.8 t0 -108.83 -9.56 15.17 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.351 -0.843 . . . . 0.0 110.233 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.497 ' C ' ' CD1' ' A' ' 109' ' ' PHE . 1.6 t80 -68.11 101.0 1.07 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.274 -0.892 . . . . 0.0 110.257 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 15.3 mt-30 -136.33 163.32 30.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.322 -0.862 . . . . 0.0 110.257 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.52 ' CD2' ' HA3' ' A' ' 68' ' ' GLY . 0.2 OUTLIER -172.45 118.2 0.36 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.218 -0.926 . . . . 0.0 110.161 180.0 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.439 ' CG2' ' C ' ' A' ' 111' ' ' TYR . 40.8 t -151.9 72.43 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.224 -0.923 . . . . 0.0 110.232 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.432 ' OD2' ' CE1' ' A' ' 111' ' ' TYR . 10.4 m-20 -121.61 -66.94 1.0 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.27 -0.894 . . . . 0.0 110.168 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.467 ' CD ' ' OD1' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -51.74 -48.12 63.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.22 -0.925 . . . . 0.0 110.284 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.467 ' OD1' ' CD ' ' A' ' 114' ' ' ARG . 1.1 m-20 -86.5 -42.9 13.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.283 -0.886 . . . . 0.0 110.181 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 78.22 6.25 87.63 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -108.19 124.85 50.9 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.232 -1.158 . . . . 0.0 110.21 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.46 92.84 0.21 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.224 -0.923 . . . . 0.0 110.222 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -126.55 0.32 6.86 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.206 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -104.95 26.09 23.36 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.563 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.7 p -88.32 -42.63 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.232 -1.158 . . . . 0.0 110.231 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.563 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.2 m-20 -37.43 -28.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.76 -0.588 . . . . 0.0 110.76 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.535 HG12 ' CG1' ' A' ' 74' ' ' VAL . 7.1 t -85.29 -64.73 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.243 -0.91 . . . . 0.0 110.211 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.452 ' HG2' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -40.6 -36.27 0.57 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.146 -0.971 . . . . 0.0 111.05 -179.467 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 128' ' ' LYS . 17.5 mm-40 -81.36 -50.81 9.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.119 -0.988 . . . . 0.0 111.191 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.464 ' HB3' ' SD ' ' A' ' 78' ' ' MET . 0.0 OUTLIER -53.59 -56.78 14.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.075 -1.016 . . . . 0.0 109.73 -179.786 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.494 ' N ' ' SD ' ' A' ' 78' ' ' MET . . . -53.78 -41.36 67.16 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.398 -0.814 . . . . 0.0 110.058 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.453 ' HB3' ' O ' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -50.78 -40.7 55.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.125 -0.984 . . . . 0.0 110.175 179.917 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -65.21 -53.1 49.64 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 110.177 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.528 HD11 ' CD1' ' A' ' 85' ' ' ILE . 17.1 tp -48.58 -32.03 7.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.216 -0.928 . . . . 0.0 110.13 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.468 HG22 HG22 ' A' ' 103' ' ' VAL . 21.4 t -78.73 -35.05 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.391 -0.818 . . . . 0.0 110.106 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.78 -52.71 55.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 0.0 110.185 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.444 ' O ' ' HB2' ' A' ' 136' ' ' ASP . 1.0 OUTLIER -66.19 -44.6 83.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.3 -0.875 . . . . 0.0 110.186 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.557 ' CD2' HG23 ' A' ' 85' ' ' ILE . 5.9 mt -46.49 -52.91 12.28 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.246 -0.909 . . . . 0.0 110.346 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 -93.45 54.51 2.07 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.292 -0.88 . . . . 0.0 110.418 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.444 ' HB2' ' O ' ' A' ' 133' ' ' LEU . 0.2 OUTLIER -85.57 -18.91 31.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.192 -0.943 . . . . 0.0 110.11 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.58 149.2 49.27 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 0.0 110.366 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.457 ' O ' ' C ' ' A' ' 139' ' ' ARG . 36.5 t0 -147.42 90.45 1.87 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.307 -0.87 . . . . 0.0 110.065 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . 0.457 ' C ' ' O ' ' A' ' 138' ' ' ASP . 0.1 OUTLIER 38.72 -160.02 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.571 -0.706 . . . . 0.0 110.624 179.696 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.6 112.75 15.87 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.198 -0.939 . . . . 0.0 110.187 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 15.4 mtm180 -64.72 -45.04 88.23 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.318 -0.864 . . . . 0.0 110.225 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 49.01 84.52 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.27 -0.894 . . . . 0.0 110.177 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -119.56 29.74 7.45 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 0.0 110.194 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 4.8 mtt-85 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.232 -179.941 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . 0.415 ' C ' ' OG ' ' A' ' -2' ' ' SER . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' SER . . . . . 0.415 ' OG ' ' C ' ' A' ' -3' ' ' GLY . 0.8 OUTLIER -162.24 130.86 4.17 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.231 -1.158 . . . . 0.0 110.159 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 52.9 m -109.38 39.83 1.99 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.0 110.253 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -112.43 -50.23 2.91 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.316 -0.865 . . . . 0.0 110.206 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.1 ptp -129.05 -30.89 2.17 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.272 -0.893 . . . . 0.0 110.326 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 50.66 86.21 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.142 -0.974 . . . . 0.0 110.112 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -132.08 163.6 28.11 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.31 -0.868 . . . . 0.0 110.191 179.936 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.418 ' C ' ' O ' ' A' ' 3' ' ' THR . 1.2 m -43.3 112.21 0.35 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.194 -0.941 . . . . 0.0 110.143 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.2 p -97.31 -67.63 0.84 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.235 -0.916 . . . . 0.0 110.279 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -166.8 120.46 1.03 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.282 -0.887 . . . . 0.0 110.284 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -59.31 173.87 0.46 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.259 -0.901 . . . . 0.0 110.243 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.7 174.06 10.69 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.2 -0.937 . . . . 0.0 110.177 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -96.27 71.94 2.81 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.256 -0.902 . . . . 0.0 110.22 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 30.5 mtp -96.15 -82.37 0.39 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 110.165 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -71.13 -40.98 71.07 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.228 -0.92 . . . . 0.0 110.123 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.472 ' OD1' ' NE2' ' A' ' 15' ' ' HIS . 49.6 t-20 -89.18 116.16 27.22 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.27 -0.894 . . . . 0.0 110.133 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 35.6 mm -110.03 -76.35 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.244 -0.91 . . . . 0.0 110.28 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 m -136.46 116.63 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.216 -0.928 . . . . 0.0 110.391 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.472 ' NE2' ' OD1' ' A' ' 12' ' ' ASN . 14.1 m170 -103.81 -61.84 1.38 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.309 -0.869 . . . . 0.0 110.165 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -172.57 89.03 0.09 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.294 -0.879 . . . . 0.0 110.231 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -92.54 167.52 11.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.184 -0.948 . . . . 0.0 110.236 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.7 p -139.27 -47.06 0.47 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.333 -0.854 . . . . 0.0 110.103 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 50.61 42.94 27.59 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.24 -0.912 . . . . 0.0 110.286 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.475 ' CB ' HD12 ' A' ' 46' ' ' LEU . . . -72.46 -42.35 65.07 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.186 -0.946 . . . . 0.0 110.265 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.457 ' HG3' HG12 ' A' ' 22' ' ' ILE . 17.2 pt-20 -43.23 -34.41 1.15 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.257 -0.902 . . . . 0.0 110.01 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.457 HG12 ' HG3' ' A' ' 21' ' ' GLU . 25.0 mm -79.83 -50.24 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.383 -0.823 . . . . 0.0 109.811 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.532 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 4.1 mptt -48.76 -27.99 3.33 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.281 -0.887 . . . . 0.0 110.096 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.552 HG23 HG23 ' A' ' 56' ' ' ILE . 91.6 t -85.42 -33.62 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.263 -0.898 . . . . 0.0 110.014 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -62.87 -43.27 99.24 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.249 -0.907 . . . . 0.0 109.921 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -33.31 61.76 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.484 -0.76 . . . . 0.0 110.061 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.585 ' HB3' HD21 ' A' ' 39' ' ' LEU . . . -64.57 -23.17 67.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.333 -0.854 . . . . 0.0 110.13 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.463 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 40.7 p -130.05 75.87 1.68 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.241 -0.912 . . . . 0.0 110.223 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 29.6 t -175.45 -74.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.159 -0.963 . . . . 0.0 110.149 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -127.62 96.03 4.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -52.52 134.38 44.24 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.934 . . . . 0.0 110.117 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -58.33 -179.47 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 123.964 1.507 . . . . 0.0 110.306 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.423 ' O ' ' C ' ' A' ' 34' ' ' GLY . 1.7 m95 -60.46 -164.31 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.292 -0.88 . . . . 0.0 110.39 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 33' ' ' TRP . . . 43.15 -148.01 0.74 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -68.56 -178.57 1.94 Allowed 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.938 1.493 . . . . 0.0 110.328 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.3 m -116.53 47.26 1.46 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.284 -0.885 . . . . 0.0 110.215 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.2 m -125.84 81.9 2.02 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.905 . . . . 0.0 110.187 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.408 ' O ' ' N ' ' A' ' 40' ' ' MET . 0.7 OUTLIER -158.42 -172.7 3.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.23 -0.919 . . . . 0.0 110.227 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.585 HD21 ' HB3' ' A' ' 27' ' ' ALA . 4.5 tp 46.68 20.11 0.1 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.278 -0.889 . . . . 0.0 110.712 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.408 ' N ' ' O ' ' A' ' 38' ' ' SER . 2.9 mtt -96.71 -43.7 7.43 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.186 -0.946 . . . . 0.0 109.869 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.0 t -67.33 -28.8 68.28 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.334 -0.854 . . . . 0.0 110.374 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.46 ' OE1' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -73.4 -50.37 22.17 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.25 -0.906 . . . . 0.0 110.359 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.532 ' CG1' ' HB3' ' A' ' 23' ' ' LYS . 20.9 mt -56.34 -36.62 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.234 -0.916 . . . . 0.0 110.272 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.498 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.05 -48.49 57.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.064 -1.023 . . . . 0.0 109.486 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.43 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -53.49 -20.68 5.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.047 -1.033 . . . . 0.0 108.995 178.856 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.475 ' O ' ' HB1' ' A' ' 52' ' ' ALA . 15.6 mt -81.5 -36.91 28.69 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.499 -0.751 . . . . 0.0 109.884 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.485 ' OG1' ' O ' ' A' ' 44' ' ' ALA . 67.9 p -51.92 -43.42 63.41 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.269 -0.972 . . . . 0.0 109.038 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.43 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 93.4 m-85 -45.02 -43.3 9.11 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.433 -0.907 . . . . 0.0 109.399 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 50' ' ' VAL . 0.8 OUTLIER -71.78 90.47 1.09 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.551 -0.718 . . . . 0.0 110.51 179.631 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.02 -58.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.609 178.175 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.564 HG11 ' N ' ' A' ' 52' ' ' ALA . 3.0 t -66.11 -66.26 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.052 -1.03 . . . . 0.0 110.345 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.564 ' N ' HG11 ' A' ' 51' ' ' VAL . . . -35.46 -42.9 0.23 Allowed 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.16 0.505 . . . . 0.0 110.833 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.599 ' CE1' ' HA ' ' A' ' 92' ' ' VAL . 32.0 t80 -58.91 -55.16 38.69 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.413 -0.804 . . . . 0.0 110.21 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.7 t -53.92 -28.18 35.34 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.316 -0.865 . . . . 0.0 109.924 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.38 -30.37 37.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.297 -0.877 . . . . 0.0 109.997 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.552 HG23 HG23 ' A' ' 24' ' ' VAL . 6.7 mt -75.89 -65.8 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.398 -0.814 . . . . 0.0 109.963 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.573 ' CG ' ' CE1' ' A' ' 53' ' ' PHE . 89.4 mmm -45.94 -34.49 3.97 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.21 -0.931 . . . . 0.0 109.792 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.6 m -57.7 -63.99 1.05 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.333 -0.854 . . . . 0.0 110.108 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.46 ' HB3' HG13 ' A' ' 24' ' ' VAL . 0.4 OUTLIER -57.93 -20.21 35.78 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.946 . . . . 0.0 110.104 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.561 HG23 HD12 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -79.67 -30.6 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.337 -0.852 . . . . 0.0 109.979 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.56 ' CD1' ' O ' ' A' ' 57' ' ' MET . 21.6 m95 -80.94 -44.74 17.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.162 -0.962 . . . . 0.0 110.162 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.73 -44.37 85.95 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.289 -0.882 . . . . 0.0 109.813 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.416 ' O ' HG22 ' A' ' 74' ' ' VAL . 2.8 mmt85 -73.75 -14.42 61.12 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.0 109.942 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.62 HD22 ' CD1' ' A' ' 106' ' ' LEU . 10.1 mt -85.0 -19.49 31.94 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.304 -0.872 . . . . 0.0 110.312 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -99.14 34.75 2.06 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.247 -0.908 . . . . 0.0 110.141 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.509 ' HB2' ' CG2' ' A' ' 74' ' ' VAL . 0.2 OUTLIER -73.13 -167.66 0.42 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.377 -0.827 . . . . 0.0 110.225 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.551 ' HA ' ' CZ ' ' A' ' 109' ' ' PHE . 2.4 p-80 -178.64 172.02 1.45 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.183 -0.948 . . . . 0.0 110.274 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.81 -125.5 7.34 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -117.34 -3.61 11.42 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.288 -1.125 . . . . 0.0 110.114 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -87.18 24.17 1.64 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.283 -0.885 . . . . 0.0 110.241 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.562 ' CZ3' ' HA ' ' A' ' 72' ' ' ARG . 21.7 p-90 -52.3 -19.53 2.14 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.251 -0.906 . . . . 0.0 110.12 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.562 ' HA ' ' CZ3' ' A' ' 71' ' ' TRP . 11.8 ptm180 -42.83 -33.18 0.72 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.309 -0.87 . . . . 0.0 110.138 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.418 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 0.6 OUTLIER -68.28 -48.58 64.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.197 -0.939 . . . . 0.0 109.961 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.537 HG11 ' CG1' ' A' ' 123' ' ' VAL . 79.5 t -53.53 -50.78 47.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 0.0 109.978 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.629 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 2.8 t80 -50.42 -58.97 4.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.215 -0.928 . . . . 0.0 109.979 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.463 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 4.9 mttt -56.62 -25.3 52.72 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.363 -0.836 . . . . 0.0 110.09 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.538 ' HB3' HD21 ' A' ' 64' ' ' LEU . . . -73.85 -34.19 64.4 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.89 . . . . 0.0 110.207 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.537 ' HE1' HG13 ' A' ' 74' ' ' VAL . 0.4 OUTLIER -65.59 -34.73 78.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.346 -0.846 . . . . 0.0 110.029 179.841 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 44.5 m -67.99 -59.68 3.08 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 110.317 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.527 ' CD1' HD11 ' A' ' 84' ' ' LEU . 25.6 tp -47.51 -55.1 9.82 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.31 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.52 ' HG2' ' CD2' ' A' ' 130' ' ' LEU . 2.0 tpt -51.3 -35.57 38.4 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.113 -0.992 . . . . 0.0 110.29 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.518 ' HB2' ' CD1' ' A' ' 130' ' ' LEU . 26.4 tt0 -71.31 -64.86 0.83 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.183 -0.948 . . . . 0.0 110.418 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.596 ' CE1' ' CG2' ' A' ' 87' ' ' THR . 45.3 t80 -43.8 -38.05 3.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.207 -0.933 . . . . 0.0 110.955 -179.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.537 ' CB ' HG11 ' A' ' 92' ' ' VAL . 68.8 mt -76.81 -34.36 57.94 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.124 -0.985 . . . . 0.0 110.751 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.544 ' N ' HG13 ' A' ' 92' ' ' VAL . 10.6 mt -50.89 -21.2 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.924 -1.11 . . . . 0.0 109.722 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.69 -77.45 0.57 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.232 -0.917 . . . . 0.0 110.156 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.596 ' CG2' ' CE1' ' A' ' 83' ' ' TYR . 13.0 t -61.85 -13.92 28.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.251 -0.906 . . . . 0.0 110.147 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.52 ' O ' ' CG2' ' A' ' 92' ' ' VAL . . . -88.82 30.9 5.19 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.495 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 71.47 157.15 0.17 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.318 -1.107 . . . . 0.0 110.431 179.961 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -66.95 -7.19 20.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.424 -0.798 . . . . 0.0 110.485 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -73.09 -40.38 65.05 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 0.0 109.714 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.599 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 86.8 t -61.09 -35.15 63.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.315 -0.866 . . . . 0.0 109.855 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.4 t -75.51 -43.84 46.87 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.156 -0.965 . . . . 0.0 109.678 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -56.79 -37.5 71.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.0 109.603 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.402 ' HG2' ' HE1' ' A' ' 57' ' ' MET . 8.2 tp-100 -65.22 -41.51 94.37 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.348 -0.845 . . . . 0.0 109.288 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.409 ' SG ' ' HG ' ' A' ' 134' ' ' LEU . 4.6 t -54.22 -42.21 69.55 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.333 -0.854 . . . . 0.0 109.236 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.458 ' CE ' ' HB2' ' A' ' 135' ' ' ARG . 0.6 OUTLIER -65.59 -34.17 77.6 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.505 -0.747 . . . . 0.0 109.351 179.283 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -78.77 -13.68 59.68 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.532 -0.73 . . . . 0.0 109.702 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -134.51 35.52 3.18 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.461 -0.774 . . . . 0.0 110.017 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.448 ' HE2' ' HA ' ' A' ' 97' ' ' LYS . 1.8 mtm -63.04 -28.44 70.1 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.245 -0.91 . . . . 0.0 110.133 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.459 ' O ' ' HB ' ' A' ' 105' ' ' THR . 44.0 m-85 -63.04 -22.66 67.01 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -0.89 . . . . 0.0 109.935 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.496 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -77.56 -41.12 40.07 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.309 -0.869 . . . . 0.0 110.069 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.458 HG11 HD21 ' A' ' 130' ' ' LEU . 3.4 t -74.75 -26.46 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.392 -0.817 . . . . 0.0 109.967 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.473 ' HG2' HG21 ' A' ' 131' ' ' VAL . 17.4 mm100 -85.64 -25.96 26.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.303 -0.873 . . . . 0.0 110.153 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.515 HG22 ' N ' ' A' ' 106' ' ' LEU . 7.5 t -62.19 -23.88 66.87 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.241 -0.912 . . . . 0.0 110.154 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.62 ' CD1' HD22 ' A' ' 64' ' ' LEU . 13.5 mt -65.03 -40.51 94.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.186 -0.946 . . . . 0.0 110.177 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.7 ttpp -53.34 -29.63 35.02 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.181 -0.949 . . . . 0.0 109.884 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.463 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 1.3 m-20 -84.67 -26.71 27.58 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.351 -0.843 . . . . 0.0 110.015 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.551 ' CZ ' ' HA ' ' A' ' 67' ' ' HIS . 1.2 t80 -61.31 96.73 0.06 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.334 -0.854 . . . . 0.0 110.088 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 20.1 mt-30 -128.6 102.87 6.79 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.292 -0.88 . . . . 0.0 110.315 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -146.02 118.69 8.59 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.264 -0.897 . . . . 0.0 110.087 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.47 HG13 ' HA3' ' A' ' 116' ' ' GLY . 92.3 t -122.43 23.37 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -0.921 . . . . 0.0 110.285 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.429 ' O ' ' O ' ' A' ' 112' ' ' VAL . 0.8 OUTLIER 52.4 174.76 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.295 -0.878 . . . . 0.0 110.282 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.32 -49.07 70.57 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.213 -0.929 . . . . 0.0 110.461 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.459 ' O ' ' OD1' ' A' ' 115' ' ' ASP . 32.5 p30 -129.94 64.63 1.51 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.083 -1.011 . . . . 0.0 110.541 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.47 ' HA3' HG13 ' A' ' 112' ' ' VAL . . . -80.14 -153.46 8.7 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 119' ' ' GLN . 8.3 tttt -109.05 39.12 2.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.153 -1.204 . . . . 0.0 110.21 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.442 ' C ' ' O ' ' A' ' 117' ' ' LYS . 15.4 t0 39.55 39.58 0.52 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.456 -0.778 . . . . 0.0 110.763 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 117' ' ' LYS . 12.2 mm100 -93.45 -97.72 0.14 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.194 -0.941 . . . . 0.0 110.04 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.437 ' C ' ' O ' ' A' ' 119' ' ' GLN . . . 42.15 27.16 0.4 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.857 -1.297 . . . . 0.0 109.857 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.563 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.2 p -127.18 -44.48 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 O-C-N 121.091 -1.24 . . . . 0.0 110.376 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.577 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 3.1 m-80 -46.26 -31.41 2.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.213 -0.929 . . . . 0.0 110.258 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.537 ' CG1' HG11 ' A' ' 74' ' ' VAL . 2.0 t -83.13 -55.2 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.25 -0.906 . . . . 0.0 110.361 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.422 ' N ' HG11 ' A' ' 123' ' ' VAL . 2.2 tmt_? -47.74 -49.78 27.32 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.009 -1.057 . . . . 0.0 111.073 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -64.85 -53.22 50.2 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.257 -0.902 . . . . 0.0 111.505 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.629 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -50.13 -45.43 52.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.982 -1.074 . . . . 0.0 110.682 -179.242 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.423 ' HB2' ' HE2' ' A' ' 78' ' ' MET . . . -67.24 -42.93 83.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.22 -0.925 . . . . 0.0 110.396 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -45.9 -55.99 6.01 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.184 -0.948 . . . . 0.0 110.276 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -58.56 -51.1 71.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 0.0 110.333 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.542 HD12 ' CD1' ' A' ' 85' ' ' ILE . 25.6 tp -46.09 -27.78 1.04 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.246 -0.909 . . . . 0.0 110.316 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.473 HG21 ' HG2' ' A' ' 104' ' ' GLN . 25.6 t -89.87 -33.87 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.208 -0.933 . . . . 0.0 110.284 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.82 -58.26 6.04 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.23 -0.919 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.6 tt -51.63 -39.5 58.2 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.22 -0.925 . . . . 0.0 110.241 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.517 HD21 HG23 ' A' ' 85' ' ' ILE . 2.9 mm? -54.37 -55.56 27.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 110.182 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.458 ' HB2' ' CE ' ' A' ' 97' ' ' LYS . 29.2 ttt-85 -139.79 82.32 1.87 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.228 -0.92 . . . . 0.0 110.196 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.25 -75.05 0.47 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.281 -0.887 . . . . 0.0 110.307 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -55.73 178.35 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.262 -0.899 . . . . 0.0 110.327 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -129.38 71.46 1.44 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.242 -0.911 . . . . 0.0 110.193 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -69.36 -160.06 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.219 -0.925 . . . . 0.0 110.297 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.4 pp -102.07 24.17 10.49 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.151 -0.968 . . . . 0.0 110.221 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.55 104.25 0.09 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.134 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.61 177.24 6.4 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.944 . . . . 0.0 110.37 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.71 164.93 0.07 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.286 -0.884 . . . . 0.0 110.277 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 51.3 ttt180 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.144 179.952 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.28 -69.31 0.74 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.239 -1.154 . . . . 0.0 110.18 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 2.2 t -112.34 79.5 1.23 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.258 -0.901 . . . . 0.0 110.159 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . 0.442 ' O ' ' CB ' ' A' ' 1' ' ' MET . 3.4 ttt180 -171.81 133.42 0.75 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.206 -0.934 . . . . 0.0 110.3 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.442 ' CB ' ' O ' ' A' ' 0' ' ' ARG . 0.0 OUTLIER 64.62 9.99 5.57 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.196 -0.94 . . . . 0.0 110.235 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -131.47 40.27 3.43 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.296 -0.877 . . . . 0.0 110.19 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 58.4 m -97.34 83.88 3.37 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.33 -0.857 . . . . 0.0 110.261 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.8 p -51.09 167.51 0.08 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.199 -0.938 . . . . 0.0 110.191 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.0 m -135.82 167.39 21.26 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.231 -0.918 . . . . 0.0 110.156 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.73 117.49 34.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.249 -0.907 . . . . 0.0 110.197 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -122.14 132.54 54.52 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.246 -0.909 . . . . 0.0 110.222 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -164.92 141.15 5.73 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.251 -0.905 . . . . 0.0 110.214 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.37 25.19 2.66 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -0.921 . . . . 0.0 110.241 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 60.1 mtt -117.77 152.91 34.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.301 -0.874 . . . . 0.0 110.229 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -92.87 -77.26 0.45 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.241 -0.912 . . . . 0.0 110.186 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -179.85 50.16 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.276 -0.89 . . . . 0.0 110.164 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.436 ' O ' ' C ' ' A' ' 14' ' ' VAL . 4.7 mt -124.32 141.42 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.291 -0.88 . . . . 0.0 110.219 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.436 ' C ' ' O ' ' A' ' 13' ' ' ILE . 4.6 t 41.89 82.12 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.38 -0.825 . . . . 0.0 110.289 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 5.1 t-160 -113.53 67.15 0.67 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.242 -0.912 . . . . 0.0 110.142 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.408 ' C ' ' OD1' ' A' ' 16' ' ' ASN . 35.3 p30 -108.4 178.66 4.43 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.297 -0.877 . . . . 0.0 110.186 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.444 ' O ' ' HB2' ' A' ' 18' ' ' SER . 74.1 m-85 -67.68 124.13 22.43 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.297 -0.877 . . . . 0.0 110.246 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.444 ' HB2' ' O ' ' A' ' 17' ' ' TYR . 43.5 t -179.2 37.82 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.306 -0.871 . . . . 0.0 110.177 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -108.22 2.06 22.52 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.245 -0.909 . . . . 0.0 110.305 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.568 ' HB3' HD21 ' A' ' 46' ' ' LEU . . . -64.67 -44.52 90.1 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.266 -0.896 . . . . 0.0 110.178 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -55.52 -42.87 75.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.177 -0.952 . . . . 0.0 110.292 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mm -63.68 -53.87 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.288 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.455 ' HB3' HG13 ' A' ' 43' ' ' ILE . 28.7 mmtm -50.74 -58.97 4.62 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.207 -0.933 . . . . 0.0 110.349 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.529 ' CG2' HG21 ' A' ' 56' ' ' ILE . 38.2 t -45.0 -44.52 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.0 110.447 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -38.64 91.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.118 -0.989 . . . . 0.0 110.334 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -72.03 -20.66 61.66 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.322 -0.861 . . . . 0.0 110.055 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.524 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -86.81 -15.94 37.7 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.198 -0.939 . . . . 0.0 110.05 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.451 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 14.0 p -112.1 44.29 1.44 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.33 -0.856 . . . . 0.0 110.102 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 m -169.38 -165.42 0.52 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.286 -0.884 . . . . 0.0 110.171 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.415 ' ND2' ' N ' ' A' ' 30' ' ' ASN . 1.5 p30 -149.57 57.51 0.99 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.278 -0.888 . . . . 0.0 110.23 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.544 ' N ' ' HD2' ' A' ' 32' ' ' PRO . 0.3 OUTLIER -62.8 -50.27 78.36 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.256 -0.903 . . . . 0.0 110.589 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' A' ' 31' ' ' ASP . 35.8 Cg_endo -73.58 170.91 18.87 Favored 'Trans proline' 0 C--N 1.309 -1.53 0 O-C-N 123.727 1.383 . . . . 0.0 110.423 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -60.27 -87.06 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.225 -0.922 . . . . 0.0 110.707 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.88 -164.12 6.61 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -62.87 -170.38 0.1 OUTLIER 'Trans proline' 0 C--N 1.305 -1.755 0 O-C-N 124.053 1.554 . . . . 0.0 110.339 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.7 m -95.02 161.97 13.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.202 -0.936 . . . . 0.0 110.19 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.2 m -93.41 86.41 5.26 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.268 -0.895 . . . . 0.0 110.229 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.14 77.89 0.27 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.159 -0.963 . . . . 0.0 110.159 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.524 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 1.6 tp -118.26 -33.16 4.46 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.28 -0.888 . . . . 0.0 110.209 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.4 ' HE3' ' CG2' ' A' ' 79' ' ' THR . 0.0 OUTLIER -60.82 -60.68 3.41 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.221 -0.925 . . . . 0.0 110.264 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.573 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 14.1 m -46.87 -28.29 1.53 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.202 -0.936 . . . . 0.0 110.216 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HB3' ' O ' ' A' ' 39' ' ' LEU . 19.5 tp10 -71.92 -50.74 26.51 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.305 -0.872 . . . . 0.0 110.249 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.524 HG23 ' CD2' ' A' ' 84' ' ' LEU . 8.1 mt -54.91 -31.46 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.137 -0.977 . . . . 0.0 110.03 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.563 ' HB1' HD23 ' A' ' 84' ' ' LEU . . . -70.48 -53.4 16.42 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.248 -0.908 . . . . 0.0 109.547 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.49 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER -53.15 -20.88 4.28 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.02 -1.05 . . . . 0.0 109.044 179.112 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.568 HD21 ' HB3' ' A' ' 20' ' ' ALA . 11.0 mt -80.66 -37.16 31.4 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.522 -0.736 . . . . 0.0 110.108 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.544 ' HA ' ' CA ' ' A' ' 53' ' ' PHE . 68.8 p -53.54 -43.14 68.17 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.031 -1.043 . . . . 0.0 109.29 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.49 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 92.6 m-85 -43.57 -41.23 4.43 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.394 -0.816 . . . . 0.0 109.523 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.536 ' O ' ' N ' ' A' ' 51' ' ' VAL . 0.5 OUTLIER -74.69 93.1 2.51 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.427 -0.796 . . . . 0.0 110.247 179.459 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.532 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.42 -57.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.535 178.262 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.554 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.8 t -64.48 -65.69 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.018 -1.051 . . . . 0.0 110.359 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.554 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -37.84 -48.87 1.16 Allowed 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.051 -177.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.544 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 2.6 t80 -55.15 -53.32 57.46 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.198 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.455 ' O ' ' HB2' ' A' ' 58' ' ' SER . 1.1 t -57.41 -26.31 60.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.179 -0.951 . . . . 0.0 110.416 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -87.58 -20.45 26.4 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.171 -0.955 . . . . 0.0 110.492 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.529 HG21 ' CG2' ' A' ' 24' ' ' VAL . 10.8 mt -78.99 -70.09 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.192 -0.942 . . . . 0.0 110.316 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.511 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 9.6 mtp -50.92 -36.79 40.24 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.174 -0.954 . . . . 0.0 109.897 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.455 ' HB2' ' O ' ' A' ' 54' ' ' SER . 42.3 t -54.37 -59.99 3.95 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.274 -0.891 . . . . 0.0 109.761 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -58.83 -28.9 66.48 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.336 -0.852 . . . . 0.0 109.587 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.557 HG23 HD12 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -66.99 -31.65 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.458 -0.776 . . . . 0.0 109.624 179.699 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.56 ' CH2' ' HE2' ' A' ' 81' ' ' MET . 41.6 m95 -76.04 -47.41 24.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.183 -0.948 . . . . 0.0 110.191 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -49.86 -61.9 1.87 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.347 -0.845 . . . . 0.0 110.393 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.455 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 20.4 mmt-85 -64.27 -19.84 65.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.244 -0.91 . . . . 0.0 110.19 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.579 ' CD2' ' CD1' ' A' ' 106' ' ' LEU . 3.2 mt -70.73 -20.41 62.64 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.169 -0.957 . . . . 0.0 110.332 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.553 ' O ' ' CD2' ' A' ' 67' ' ' HIS . 10.3 m-20 -106.63 38.02 2.17 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.188 -0.945 . . . . 0.0 110.218 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.476 ' O ' ' CZ ' ' A' ' 109' ' ' PHE . 0.7 OUTLIER -61.0 140.6 57.79 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.293 -0.879 . . . . 0.0 110.14 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.553 ' CD2' ' O ' ' A' ' 65' ' ' ASN . 91.1 m-70 -124.32 -179.82 4.61 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.457 -0.777 . . . . 0.0 110.191 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 70.32 -105.47 1.59 Allowed Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.46 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 2.3 ttpt -140.59 72.27 1.39 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.239 -1.153 . . . . 0.0 110.149 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -151.43 29.61 0.62 Allowed 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.381 -0.825 . . . . 0.0 110.287 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.557 ' CZ3' ' HG3' ' A' ' 72' ' ' ARG . 46.1 p-90 -54.47 -17.72 3.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.242 -0.912 . . . . 0.0 110.308 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.557 ' HG3' ' CZ3' ' A' ' 71' ' ' TRP . 0.9 OUTLIER -53.75 -42.01 67.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.208 -0.933 . . . . 0.0 110.232 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.451 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 27.5 m170 -66.05 -39.81 90.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.2 -0.938 . . . . 0.0 110.244 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.529 HG11 ' CG1' ' A' ' 123' ' ' VAL . 9.6 t -55.49 -57.12 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.178 -0.951 . . . . 0.0 110.175 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.625 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 17.3 t80 -48.77 -66.77 0.34 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -0.924 . . . . 0.0 110.019 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.451 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.3 OUTLIER -49.22 -25.29 2.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.366 -0.834 . . . . 0.0 109.963 179.851 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.561 ' HB2' HD23 ' A' ' 64' ' ' LEU . . . -67.75 -50.71 55.82 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.278 -0.889 . . . . 0.0 110.172 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.549 ' HE3' HG12 ' A' ' 123' ' ' VAL . 3.2 mpp? -54.91 -29.79 56.83 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.358 -0.839 . . . . 0.0 110.198 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.4 ' CG2' ' HE3' ' A' ' 40' ' ' MET . 2.6 m -67.59 -53.88 24.47 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.355 -0.841 . . . . 0.0 110.527 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.54 ' HG ' ' CD1' ' A' ' 84' ' ' LEU . 21.0 tp -55.84 -53.33 58.04 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.224 -0.922 . . . . 0.0 110.106 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.56 ' HE2' ' CH2' ' A' ' 61' ' ' TRP . 0.4 OUTLIER -55.0 -24.99 26.95 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.095 -1.003 . . . . 0.0 110.446 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.526 ' CA ' HD12 ' A' ' 130' ' ' LEU . 2.8 tt0 -79.37 -59.44 2.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.066 -1.021 . . . . 0.0 110.436 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.584 ' CE1' ' CG2' ' A' ' 87' ' ' THR . 17.8 t80 -53.45 -31.35 45.11 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.423 -0.798 . . . . 0.0 111.013 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.563 HD23 ' HB1' ' A' ' 44' ' ' ALA . 73.9 mt -77.87 -29.98 50.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 0.0 110.638 -179.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.545 ' N ' HG11 ' A' ' 92' ' ' VAL . 26.5 mt -64.09 -11.59 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.087 -1.008 . . . . 0.0 109.974 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -107.43 -72.35 0.72 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.27 -0.894 . . . . 0.0 110.168 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.584 ' CG2' ' CE1' ' A' ' 83' ' ' TYR . 12.2 t -89.16 1.3 55.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.15 -0.969 . . . . 0.0 110.189 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.547 ' O ' ' CB ' ' A' ' 89' ' ' SER . . . -91.35 28.1 8.62 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.5 OUTLIER 75.06 149.29 0.1 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.562 -0.964 . . . . 0.0 110.114 -179.822 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.74 -10.3 12.33 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.391 -0.818 . . . . 0.0 110.635 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 73.8 mtp85 -70.32 -45.82 65.46 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.059 -1.026 . . . . 0.0 109.647 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.545 HG11 ' N ' ' A' ' 85' ' ' ILE . 96.9 t -52.56 -30.94 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 O-C-N 121.488 -0.758 . . . . 0.0 110.039 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.463 ' HA ' HG12 ' A' ' 85' ' ' ILE . 21.0 t -81.23 -37.39 28.66 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.323 -0.861 . . . . 0.0 109.884 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.407 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 24.4 mm-40 -56.61 -52.55 64.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -0.873 . . . . 0.0 109.927 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.437 ' HB3' ' SD ' ' A' ' 57' ' ' MET . 7.0 tp60 -57.26 -36.95 71.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.465 -0.772 . . . . 0.0 109.594 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.6 t -57.22 -39.64 75.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.272 -0.892 . . . . 0.0 109.651 179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -71.79 -30.3 65.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.497 -0.752 . . . . 0.0 109.66 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 61.9 mt-10 -83.94 -11.83 56.27 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.453 -0.779 . . . . 0.0 110.029 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -128.41 32.08 4.91 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.375 -0.828 . . . . 0.0 110.133 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.401 ' O ' ' HB2' ' A' ' 104' ' ' GLN . 1.4 ppp? -63.9 -20.44 65.85 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.263 -0.898 . . . . 0.0 110.118 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.474 ' O ' ' HB ' ' A' ' 105' ' ' THR . 31.6 m-85 -75.97 -20.85 57.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.277 -0.889 . . . . 0.0 110.274 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.539 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -85.72 -39.85 16.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.155 -0.966 . . . . 0.0 110.106 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.568 ' CG1' ' N ' ' A' ' 104' ' ' GLN . 3.6 p -73.93 -41.91 53.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.637 0 CA-C-O 122.033 0.92 . . . . 0.0 109.141 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.568 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 3.7 mm-40 -69.42 -24.51 63.85 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.68 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.539 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 5.0 t -59.53 -27.77 66.48 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.953 -1.092 . . . . 0.0 109.932 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.579 ' CD1' ' CD2' ' A' ' 64' ' ' LEU . 61.8 mt -59.44 -37.74 78.89 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.324 -0.86 . . . . 0.0 110.144 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.422 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 34.8 ttpt -45.93 -32.41 2.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.021 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -94.94 -27.19 15.8 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.381 -0.825 . . . . 0.0 110.075 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.476 ' CZ ' ' O ' ' A' ' 66' ' ' ASP . 3.0 t80 -44.64 118.12 1.49 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.316 -0.865 . . . . 0.0 110.24 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -156.57 165.09 37.27 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.313 -0.867 . . . . 0.0 110.156 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.407 ' O ' HG22 ' A' ' 112' ' ' VAL . 0.2 OUTLIER -165.95 114.86 0.97 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.251 -0.906 . . . . 0.0 110.286 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.458 ' CG1' ' N ' ' A' ' 117' ' ' LYS . 19.3 t -140.85 78.23 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.206 -0.933 . . . . 0.0 110.339 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -110.06 -89.91 0.48 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 110.085 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.7 ptt-85 -52.11 -48.31 64.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.287 -0.883 . . . . 0.0 110.254 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -63.07 -82.03 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.313 -0.867 . . . . 0.0 110.129 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.444 ' C ' ' CG1' ' A' ' 112' ' ' VAL . . . 123.3 10.51 5.54 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.458 ' N ' ' CG1' ' A' ' 112' ' ' VAL . 0.4 OUTLIER -133.63 144.83 49.49 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.267 -1.137 . . . . 0.0 110.201 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -45.42 130.74 8.51 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.273 -0.892 . . . . 0.0 110.164 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -44.15 -77.55 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.23 -0.919 . . . . 0.0 110.252 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -161.26 151.86 22.28 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.54 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.0 p -93.28 -41.09 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.347 -1.09 . . . . 0.0 110.149 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.54 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 15.3 m-20 -36.36 -29.1 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.877 -0.514 . . . . 0.0 111.022 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.549 HG12 ' HE3' ' A' ' 78' ' ' MET . 12.0 t -73.72 -64.72 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.122 -0.986 . . . . 0.0 110.358 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.422 ' HG3' ' HA ' ' A' ' 107' ' ' LYS . 35.5 ttp180 -51.96 -31.25 28.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.256 -0.902 . . . . 0.0 110.77 -179.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -76.31 -46.98 25.25 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.173 -0.955 . . . . 0.0 110.617 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.625 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -55.43 -49.71 71.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.99 . . . . 0.0 110.257 -179.763 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.539 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -66.33 -41.31 89.78 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.305 -0.872 . . . . 0.0 110.712 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -34.25 73.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.178 -0.951 . . . . 0.0 110.762 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -77.67 -28.54 51.17 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.183 -0.948 . . . . 0.0 110.861 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.529 HD23 ' CD1' ' A' ' 85' ' ' ILE . 5.1 tt -68.74 -48.0 64.89 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.134 -0.979 . . . . 0.0 110.282 -179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.483 HG23 ' CG1' ' A' ' 103' ' ' VAL . 5.3 t -69.4 -28.18 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.261 -0.899 . . . . 0.0 110.137 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.48 -47.12 57.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.852 . . . . 0.0 110.432 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.98 -33.56 70.82 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.18 -0.95 . . . . 0.0 110.4 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.542 ' CD1' HG23 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -73.24 -65.36 0.82 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.168 -0.958 . . . . 0.0 110.425 -179.929 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -92.03 40.05 1.03 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.202 -0.936 . . . . 0.0 110.305 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.416 ' O ' ' O ' ' A' ' 137' ' ' GLU . 10.6 t0 -62.15 -19.15 62.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.244 -0.91 . . . . 0.0 110.161 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.416 ' O ' ' O ' ' A' ' 136' ' ' ASP . 0.4 OUTLIER -56.93 -164.09 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.167 -0.958 . . . . 0.0 110.048 179.94 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 55.48 95.27 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.152 -0.968 . . . . 0.0 110.244 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -55.13 156.76 3.81 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.209 -0.932 . . . . 0.0 110.296 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.12 133.25 42.67 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.121 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 7.5 mtt-85 -53.76 158.11 2.08 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.24 -0.913 . . . . 0.0 110.211 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -169.53 144.85 3.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.193 -0.942 . . . . 0.0 110.263 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -138.69 144.45 39.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.304 -0.872 . . . . 0.0 110.135 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 25.9 ttt180 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.171 179.949 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.382 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' SER . . . . . 0.425 ' O ' ' CB ' ' A' ' -1' ' ' SER . 19.7 m -146.6 89.57 1.85 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.286 -1.126 . . . . 0.0 110.252 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' SER . . . . . 0.425 ' CB ' ' O ' ' A' ' -2' ' ' SER . 0.9 OUTLIER 64.4 -161.45 0.28 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.241 -0.912 . . . . 0.0 110.236 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -144.64 137.84 26.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.249 -0.907 . . . . 0.0 110.269 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 ttp -95.72 162.8 13.45 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.186 -0.946 . . . . 0.0 110.132 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -136.18 172.24 13.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.237 -0.914 . . . . 0.0 110.226 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.77 161.56 37.77 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.242 -0.912 . . . . 0.0 110.306 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.6 -172.81 2.16 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.247 -0.908 . . . . 0.0 110.251 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.42 -143.3 0.23 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.269 -0.894 . . . . 0.0 110.228 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.2 tp -142.52 -72.03 0.32 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.258 -0.901 . . . . 0.0 110.203 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -135.72 171.14 14.89 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.217 -0.927 . . . . 0.0 110.238 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.3 mtm-85 -47.39 -67.97 0.23 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.26 -0.9 . . . . 0.0 110.259 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -135.31 179.73 6.15 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.2 -0.938 . . . . 0.0 110.226 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.2 mtt -124.34 -165.54 1.38 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -0.942 . . . . 0.0 110.025 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -44.57 158.14 0.06 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.191 -0.943 . . . . 0.0 110.016 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.454 ' O ' ' HB ' ' A' ' 13' ' ' ILE . 27.4 t30 -155.77 -37.95 0.08 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.23 -0.918 . . . . 0.0 110.308 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.454 ' HB ' ' O ' ' A' ' 12' ' ' ASN . 2.0 mt 60.07 124.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.288 -0.882 . . . . 0.0 110.251 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.2 p -101.49 133.25 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.201 -0.937 . . . . 0.0 110.394 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -145.76 28.39 1.16 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.341 -0.849 . . . . 0.0 110.096 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -84.81 -141.27 0.08 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.265 -0.897 . . . . 0.0 110.345 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.479 ' O ' ' CB ' ' A' ' 18' ' ' SER . 43.6 p90 -77.05 140.86 40.44 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.286 -0.884 . . . . 0.0 110.368 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.479 ' CB ' ' O ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER 169.81 52.1 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.298 -0.876 . . . . 0.0 109.958 179.879 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.421 ' O ' ' HB ' ' A' ' 22' ' ' ILE . 50.7 mt-10 -103.49 7.86 37.85 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.173 -0.954 . . . . 0.0 110.491 -179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.493 ' HB3' HD23 ' A' ' 46' ' ' LEU . . . -56.86 -54.59 44.71 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.156 -0.965 . . . . 0.0 110.129 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' A' ' 20' ' ' ALA . 5.7 pt-20 -43.75 -26.49 0.25 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.095 -1.003 . . . . 0.0 109.975 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.421 ' HB ' ' O ' ' A' ' 19' ' ' GLU . 21.5 mm -77.72 -49.01 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.293 -0.879 . . . . 0.0 110.074 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.67 -42.94 75.83 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.296 -0.878 . . . . 0.0 110.138 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.506 HG11 ' CD2' ' A' ' 80' ' ' LEU . 78.4 t -65.43 -41.96 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.249 -0.907 . . . . 0.0 110.048 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -50.42 -44.86 55.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.197 -0.939 . . . . 0.0 110.159 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -79.04 -26.98 43.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.382 -0.824 . . . . 0.0 110.188 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' CD2' ' A' ' 39' ' ' LEU . . . -64.42 -23.06 67.16 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.166 -0.959 . . . . 0.0 110.197 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.4 p -118.9 68.87 0.8 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 110.178 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -161.99 -73.73 0.05 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 110.174 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -175.98 135.81 0.29 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.349 -0.845 . . . . 0.0 110.084 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -165.36 121.77 1.03 Allowed Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.235 -0.916 . . . . 0.0 110.21 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.428 ' O ' ' O ' ' A' ' 33' ' ' TRP . 27.9 Cg_exo -56.96 -163.05 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 123.855 1.45 . . . . 0.0 110.26 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.428 ' O ' ' O ' ' A' ' 32' ' ' PRO . 0.6 OUTLIER -57.23 -160.06 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.272 -0.893 . . . . 0.0 110.536 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 166.19 77.59 0.03 OUTLIER Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -66.49 -22.55 51.57 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.977 1.514 . . . . 0.0 110.372 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.2 t -74.0 -152.09 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.202 -0.936 . . . . 0.0 110.276 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.8 m -54.53 161.98 1.28 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.286 -0.884 . . . . 0.0 110.242 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.59 123.48 49.01 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.246 -0.909 . . . . 0.0 110.128 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.502 ' CD2' ' HB1' ' A' ' 27' ' ' ALA . 1.1 tp -50.97 -28.71 10.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.269 -0.894 . . . . 0.0 110.122 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.462 ' HE3' HG22 ' A' ' 79' ' ' THR . 3.9 mtm -70.11 -43.42 71.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.193 -0.942 . . . . 0.0 110.152 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.467 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 0.1 OUTLIER -60.6 -35.56 76.42 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.286 -0.884 . . . . 0.0 110.129 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -73.51 -39.55 64.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.274 -0.891 . . . . 0.0 110.121 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.523 ' CG2' HD11 ' A' ' 80' ' ' LEU . 67.8 mt -64.79 -33.15 61.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 0.0 109.968 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.51 ' HB3' HD21 ' A' ' 84' ' ' LEU . . . -74.58 -48.64 25.51 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.213 -0.929 . . . . 0.0 108.956 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.7 -23.03 5.89 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.493 HD23 ' HB3' ' A' ' 20' ' ' ALA . 9.9 mt -77.3 -39.57 47.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.831 -0.543 . . . . 0.0 109.942 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.546 HG23 HG23 ' A' ' 92' ' ' VAL . 81.0 p -48.79 -42.85 37.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.103 -0.998 . . . . 0.0 109.037 179.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.579 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 75.3 m-85 -45.05 -47.66 11.79 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.196 -0.94 . . . . 0.0 109.199 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.533 ' O ' ' C ' ' A' ' 50' ' ' VAL . 2.3 m-80 -66.88 89.83 0.17 Allowed 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.46 0.648 . . . . 0.0 110.421 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.533 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.19 -59.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.681 178.331 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.556 HG13 ' N ' ' A' ' 52' ' ' ALA . 2.7 t -64.57 -65.09 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.157 -0.964 . . . . 0.0 110.424 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.556 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -36.52 -43.63 0.4 Allowed 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.149 0.5 . . . . 0.0 111.173 -177.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.589 ' CE1' ' HA ' ' A' ' 92' ' ' VAL . 6.5 t80 -58.99 -58.11 10.1 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.242 -0.911 . . . . 0.0 110.454 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.8 t -51.42 -36.0 41.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.258 -0.901 . . . . 0.0 110.46 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.9 -28.9 60.82 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.304 -0.873 . . . . 0.0 110.402 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.492 HG22 ' CG2' ' A' ' 24' ' ' VAL . 22.2 mt -73.03 -70.01 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -0.89 . . . . 0.0 110.472 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.535 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 65.2 mmm -46.14 -36.35 5.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.096 -1.003 . . . . 0.0 110.021 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.5 m -53.83 -63.84 1.02 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.325 -0.86 . . . . 0.0 110.197 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.438 ' HE1' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -56.9 -31.44 64.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.066 -1.021 . . . . 0.0 109.478 179.696 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.535 HD12 ' CD2' ' A' ' 80' ' ' LEU . 0.8 OUTLIER -63.15 -34.12 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.467 -0.771 . . . . 0.0 109.852 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 57' ' ' MET . 34.6 m95 -78.15 -29.33 48.65 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.186 -0.946 . . . . 0.0 110.186 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -58.74 7.09 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.243 -0.911 . . . . 0.0 110.197 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.462 ' HB3' ' HB3' ' A' ' 73' ' ' HIS . 2.8 mtt180 -71.04 -15.62 62.56 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.279 -0.888 . . . . 0.0 110.127 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.618 HD21 HD13 ' A' ' 106' ' ' LEU . 13.5 mt -80.73 -8.33 59.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.354 -0.841 . . . . 0.0 110.581 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -82.29 26.47 0.54 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.238 -0.914 . . . . 0.0 111.223 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.579 ' OD1' ' CG ' ' A' ' 109' ' ' PHE . 6.2 m-20 52.92 174.87 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.335 -0.853 . . . . 0.0 110.806 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.444 ' HB3' ' HB2' ' A' ' 70' ' ' ASN . 0.2 OUTLIER -170.32 170.32 7.21 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.693 -0.629 . . . . 0.0 109.868 179.753 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -52.78 -88.14 0.01 OUTLIER Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.484 ' O ' ' CG ' ' A' ' 69' ' ' LYS . 12.5 tttt -111.14 58.52 0.62 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.256 -1.143 . . . . 0.0 109.995 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.444 ' HB2' ' HB3' ' A' ' 67' ' ' HIS . 50.1 m-80 -145.16 16.37 1.53 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.258 -0.902 . . . . 0.0 110.164 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.546 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 44.0 p-90 -48.07 -25.2 1.33 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.258 -0.901 . . . . 0.0 110.236 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.546 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 38.7 mtt180 -49.24 -48.04 46.02 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.217 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.462 ' HB3' ' HB3' ' A' ' 63' ' ' ARG . 30.1 m170 -54.19 -47.75 71.72 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.267 -0.896 . . . . 0.0 110.176 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.594 ' CG1' ' CG2' ' A' ' 123' ' ' VAL . 47.1 t -47.96 -50.4 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.257 -0.902 . . . . 0.0 110.206 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -52.6 -61.36 2.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.225 -0.922 . . . . 0.0 109.94 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.457 ' HE2' ' O ' ' A' ' 72' ' ' ARG . 8.5 mtmm -52.32 -23.17 5.4 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.239 -0.913 . . . . 0.0 109.476 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.563 ' HB1' ' CD2' ' A' ' 64' ' ' LEU . . . -70.91 -46.54 62.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.344 -0.848 . . . . 0.0 109.909 179.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.523 ' CE ' HG21 ' A' ' 123' ' ' VAL . 0.1 OUTLIER -53.19 -37.62 62.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.451 -0.781 . . . . 0.0 109.967 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.473 ' O ' ' HB3' ' A' ' 82' ' ' GLU . 1.9 m -62.86 -63.09 1.31 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.191 -0.943 . . . . 0.0 110.15 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.535 ' CD2' HD12 ' A' ' 60' ' ' ILE . 15.3 tp -44.86 -69.55 0.13 Allowed 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.199 -0.938 . . . . 0.0 109.39 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.468 ' O ' HG13 ' A' ' 85' ' ' ILE . 6.5 ttp -39.09 -35.96 0.27 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.495 -0.753 . . . . 0.0 110.811 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.473 ' HB3' ' O ' ' A' ' 79' ' ' THR . 1.6 tm-20 -69.54 -66.16 0.62 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.011 -1.056 . . . . 0.0 110.247 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.497 ' CE1' HG21 ' A' ' 87' ' ' THR . 24.1 t80 -41.76 -48.81 4.32 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.237 -0.914 . . . . 0.0 110.841 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 80' ' ' LEU . 7.5 mt -59.85 -48.48 81.52 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.084 -1.01 . . . . 0.0 110.278 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.479 ' CA ' HG12 ' A' ' 92' ' ' VAL . 76.0 mt -55.08 -23.37 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.189 -0.945 . . . . 0.0 110.008 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -87.73 -77.44 0.35 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.24 -0.912 . . . . 0.0 110.146 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.497 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.9 t -89.64 -20.56 23.54 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 110.258 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.579 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -43.74 -73.93 0.23 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.3 OUTLIER 172.32 175.09 0.09 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.194 -1.18 . . . . 0.0 110.223 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -73.65 -16.81 61.21 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.235 -0.916 . . . . 0.0 110.168 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -76.57 -35.09 58.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.252 -0.905 . . . . 0.0 110.05 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.589 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 69.9 t -63.06 -51.92 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.211 -0.931 . . . . 0.0 110.053 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 p -61.37 -43.2 99.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.199 -0.938 . . . . 0.0 109.993 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 6.4 mm-40 -53.18 -49.45 66.67 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.229 -0.919 . . . . 0.0 109.815 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.466 ' OE1' ' CB ' ' A' ' 57' ' ' MET . 5.2 tt0 -55.35 -44.01 75.57 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.489 -0.757 . . . . 0.0 109.62 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -43.21 62.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.336 -0.853 . . . . 0.0 109.432 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -66.73 -35.36 79.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.752 . . . . 0.0 109.829 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 19.7 mt-10 -78.62 -11.06 59.95 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.362 -0.836 . . . . 0.0 109.887 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -136.21 38.45 2.73 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.356 -0.84 . . . . 0.0 110.068 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 3.5 mtp -62.76 -33.29 74.85 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.286 -0.884 . . . . 0.0 110.221 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.451 ' O ' ' HB ' ' A' ' 105' ' ' THR . 4.2 m-30 -59.99 -21.12 60.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.322 -0.861 . . . . 0.0 110.039 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.453 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -81.87 -42.68 19.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.347 -0.845 . . . . 0.0 110.139 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.518 HG11 ' CG2' ' A' ' 131' ' ' VAL . 2.5 t -75.22 -19.59 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.38 -0.825 . . . . 0.0 109.927 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -91.89 -32.17 15.4 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.291 -0.881 . . . . 0.0 110.115 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.478 HG22 ' N ' ' A' ' 106' ' ' LEU . 14.7 t -58.15 -23.82 56.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.314 -0.866 . . . . 0.0 109.873 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.618 HD13 HD21 ' A' ' 64' ' ' LEU . 11.4 mt -69.19 -41.07 77.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.319 -0.863 . . . . 0.0 110.041 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.4 ' O ' ' HD2' ' A' ' 124' ' ' ARG . 6.2 ttpp -49.39 -28.74 5.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.337 -0.852 . . . . 0.0 110.258 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -99.23 -24.24 14.92 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.279 -0.888 . . . . 0.0 110.359 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.579 ' CG ' ' OD1' ' A' ' 66' ' ' ASP . 2.5 t80 -45.47 118.66 1.83 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.235 -0.915 . . . . 0.0 110.172 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 0.0 OUTLIER -147.9 148.58 30.98 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.317 -0.864 . . . . 0.0 109.958 179.803 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' A' ' 110' ' ' GLN . 1.9 t80 -176.91 127.13 0.16 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.063 -1.023 . . . . 0.0 110.242 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.401 ' CG1' ' C ' ' A' ' 116' ' ' GLY . 21.6 t -131.44 31.0 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.241 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t70 60.37 -144.84 0.5 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.264 -0.897 . . . . 0.0 110.159 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -66.6 0.89 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.33 -0.857 . . . . 0.0 109.532 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.42 71.76 0.98 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.543 -0.723 . . . . 0.0 110.206 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.401 ' C ' ' CG1' ' A' ' 112' ' ' VAL . . . -117.47 -164.15 13.19 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -116.67 160.85 20.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -1.143 . . . . 0.0 110.189 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -76.38 93.17 3.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.206 -0.934 . . . . 0.0 110.348 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -122.76 35.79 4.8 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.952 . . . . 0.0 110.213 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.465 ' O ' ' HG3' ' A' ' 124' ' ' ARG . . . -136.89 32.3 2.46 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.558 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.5 p -87.69 -44.22 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.162 -1.199 . . . . 0.0 109.93 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.558 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.5 OUTLIER -45.18 -49.8 11.85 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.421 -0.799 . . . . 0.0 110.104 179.868 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.594 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 7.1 p -59.49 -37.51 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 0.0 110.384 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.465 ' HG3' ' O ' ' A' ' 120' ' ' GLY . 14.8 mtm180 -62.75 -68.11 0.36 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.21 -0.931 . . . . 0.0 110.789 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.474 ' HG3' ' O ' ' A' ' 122' ' ' ASN . 0.0 OUTLIER -52.51 -33.26 44.26 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.311 -0.868 . . . . 0.0 110.96 -179.321 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 0.7 OUTLIER -59.56 -55.23 37.18 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.938 -1.101 . . . . 0.0 110.175 -179.937 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.408 ' HB3' ' HE2' ' A' ' 78' ' ' MET . . . -53.89 -41.32 67.46 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.235 -0.915 . . . . 0.0 110.44 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.75 -35.66 75.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.247 -0.908 . . . . 0.0 110.421 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -66.72 -50.9 61.29 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.246 -0.909 . . . . 0.0 110.43 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.524 ' O ' ' CD1' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -54.11 -29.63 45.6 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.209 -0.932 . . . . 0.0 110.156 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.518 ' CG2' HG11 ' A' ' 103' ' ' VAL . 85.6 t -83.33 -29.6 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.307 -0.871 . . . . 0.0 110.224 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.4 -50.9 41.65 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.354 -0.842 . . . . 0.0 110.402 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.427 ' HA ' ' OD2' ' A' ' 136' ' ' ASP . 0.8 OUTLIER -63.31 -51.44 66.0 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.211 -0.93 . . . . 0.0 110.382 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.524 ' CD1' ' O ' ' A' ' 130' ' ' LEU . 0.4 OUTLIER -52.23 -39.17 59.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.178 -0.951 . . . . 0.0 110.301 -179.989 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.476 ' O ' ' CG ' ' A' ' 135' ' ' ARG . 0.5 OUTLIER -114.05 58.89 0.68 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.115 -0.991 . . . . 0.0 110.244 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.427 ' OD2' ' HA ' ' A' ' 133' ' ' LEU . 5.6 m-20 -80.36 -59.98 2.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.081 -1.012 . . . . 0.0 110.247 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -50.27 160.63 0.36 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.17 -0.956 . . . . 0.0 110.258 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -132.11 150.07 52.24 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.297 -0.877 . . . . 0.0 110.299 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.33 27.29 1.97 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.27 -0.894 . . . . 0.0 110.313 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 50.94 63.12 2.37 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.223 -0.923 . . . . 0.0 110.184 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' A' ' 142' ' ' GLU . 4.5 mtt85 -68.97 -41.35 78.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.269 -0.894 . . . . 0.0 110.247 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' A' ' 141' ' ' ARG . 0.0 OUTLIER 60.3 -170.08 0.15 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.211 -0.931 . . . . 0.0 110.235 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 61.68 157.37 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.29 -0.881 . . . . 0.0 110.203 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.201 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -115.95 178.52 4.28 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.291 -1.123 . . . . 0.0 110.244 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 2.6 t 179.31 159.21 0.66 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.304 -0.872 . . . . 0.0 110.218 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 51.48 48.2 23.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.266 -0.896 . . . . 0.0 110.242 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.79 -11.1 12.93 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.234 -0.916 . . . . 0.0 110.187 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 50.63 -174.45 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.288 -0.883 . . . . 0.0 110.161 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.1 m -153.19 49.45 0.71 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.237 -0.914 . . . . 0.0 110.227 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.7 t -103.81 -18.16 14.77 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.275 -0.891 . . . . 0.0 110.181 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 95.2 p -160.22 146.61 15.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.93 . . . . 0.0 110.131 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -173.3 74.0 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.244 -0.91 . . . . 0.0 110.256 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.0 ttt180 -141.52 76.47 1.55 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.262 -0.899 . . . . 0.0 110.2 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.8 -35.9 9.28 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.235 -0.916 . . . . 0.0 110.385 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -61.18 -167.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.131 -0.981 . . . . 0.0 110.194 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -125.59 -146.36 0.34 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.211 -0.931 . . . . 0.0 110.19 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.433 ' O ' ' C ' ' A' ' 12' ' ' ASN . 1.7 mttt -49.93 -91.96 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.231 -0.918 . . . . 0.0 110.214 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.433 ' C ' ' O ' ' A' ' 11' ' ' LYS . 7.3 t30 42.47 77.74 0.06 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.208 -0.933 . . . . 0.0 110.231 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 mt -76.21 -71.22 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.322 -0.861 . . . . 0.0 110.284 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.7 m -143.06 144.25 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.252 -0.905 . . . . 0.0 110.31 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -116.95 41.06 2.83 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.248 -0.908 . . . . 0.0 110.048 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.86 174.72 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.274 -0.891 . . . . 0.0 110.225 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.41 ' O ' ' CB ' ' A' ' 18' ' ' SER . 16.5 m-85 -78.44 167.35 21.44 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.304 -0.873 . . . . 0.0 110.215 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.41 ' CB ' ' O ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER 174.14 45.8 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 110.031 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -87.98 4.15 46.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.394 -0.816 . . . . 0.0 110.502 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.492 ' CB ' HD23 ' A' ' 46' ' ' LEU . . . -66.71 -48.59 68.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.096 -1.002 . . . . 0.0 110.236 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.423 ' C ' ' O ' ' A' ' 20' ' ' ALA . 24.4 pt-20 -43.55 -34.71 1.46 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.105 -0.997 . . . . 0.0 110.153 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.403 HG13 ' HG3' ' A' ' 21' ' ' GLU . 67.4 mt -74.53 -41.19 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.27 -0.894 . . . . 0.0 110.108 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -59.79 -46.5 88.99 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.225 -0.922 . . . . 0.0 110.193 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.532 ' CG2' HG21 ' A' ' 56' ' ' ILE . 16.8 t -60.27 -35.92 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.232 -0.917 . . . . 0.0 110.1 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -35.69 80.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.232 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -77.17 -34.8 56.33 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.238 -0.914 . . . . 0.0 110.085 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.511 ' N ' HD22 ' A' ' 39' ' ' LEU . . . -63.66 -24.13 67.66 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.29 -0.881 . . . . 0.0 110.119 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.483 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 56.2 p -115.45 55.16 0.78 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.222 -0.923 . . . . 0.0 110.088 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.8 t -67.92 -63.76 1.0 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.322 -0.861 . . . . 0.0 110.295 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -140.38 -61.23 0.51 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.215 -0.928 . . . . 0.0 110.348 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -142.75 152.83 60.36 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.211 -0.931 . . . . 0.0 110.23 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.447 ' O ' ' CB ' ' A' ' 33' ' ' TRP . 19.5 Cg_endo -65.29 -178.57 0.87 Allowed 'Trans proline' 0 C--N 1.307 -1.658 0 O-C-N 123.983 1.517 . . . . 0.0 110.555 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.447 ' CB ' ' O ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER 67.47 175.28 0.26 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.28 -0.887 . . . . 0.0 110.366 -179.919 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 121.67 -158.02 16.43 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.68 145.56 87.03 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.044 1.549 . . . . 0.0 110.51 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.22 122.86 16.66 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.281 -0.887 . . . . 0.0 110.216 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.3 m -127.82 169.04 14.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.308 -0.87 . . . . 0.0 110.064 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -120.12 50.16 1.33 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.192 -0.942 . . . . 0.0 110.43 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.511 HD22 ' N ' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -110.32 -30.12 7.84 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.12 -0.987 . . . . 0.0 110.255 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 16.6 mtt -62.23 -62.16 1.96 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.271 -0.893 . . . . 0.0 110.242 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.45 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 50.0 m -53.97 -18.53 3.59 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.317 -0.865 . . . . 0.0 110.322 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -57.75 3.59 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 0.0 110.423 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.516 ' CG2' HD13 ' A' ' 80' ' ' LEU . 4.1 mt -48.34 -30.68 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.144 -0.973 . . . . 0.0 110.143 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.561 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -71.28 -56.04 6.82 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.095 -1.003 . . . . 0.0 109.558 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.426 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 12.1 t0 -49.98 -24.37 2.55 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.944 -1.098 . . . . 0.0 108.83 179.096 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.531 ' O ' ' CB ' ' A' ' 52' ' ' ALA . 2.5 mt -74.04 -43.01 59.4 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.623 -0.673 . . . . 0.0 109.965 179.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.535 HG23 HG21 ' A' ' 92' ' ' VAL . 70.7 p -48.49 -42.97 34.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.163 -0.961 . . . . 0.0 109.324 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.568 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 79.8 m-85 -46.2 -47.48 17.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.261 -0.9 . . . . 0.0 109.237 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.549 ' O ' ' C ' ' A' ' 50' ' ' VAL . 1.1 t30 -68.74 91.34 0.44 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.549 -0.72 . . . . 0.0 110.434 179.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.549 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.65 -59.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.159 177.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.547 HG13 ' N ' ' A' ' 52' ' ' ALA . 2.6 t -62.65 -64.39 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.033 -1.042 . . . . 0.0 110.076 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.547 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -36.18 -48.09 0.6 Allowed 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.891 -177.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.504 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 13.9 t80 -57.67 -54.17 49.87 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.278 -0.889 . . . . 0.0 110.069 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.442 ' O ' ' OG ' ' A' ' 58' ' ' SER . 12.8 t -54.5 -24.6 21.2 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.298 -0.876 . . . . 0.0 110.042 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 51' ' ' VAL . 14.4 mm-40 -86.14 -28.02 24.24 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.283 -0.886 . . . . 0.0 109.973 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.532 HG21 ' CG2' ' A' ' 24' ' ' VAL . 6.4 mt -80.67 -70.31 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.345 -0.847 . . . . 0.0 110.147 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.439 ' HG2' ' HG2' ' A' ' 95' ' ' GLN . 0.9 OUTLIER -46.22 -39.42 9.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.322 -0.861 . . . . 0.0 110.031 179.766 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 54' ' ' SER . 4.4 m -56.44 -58.83 6.34 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.288 -0.882 . . . . 0.0 110.062 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 18.9 mmt -63.01 -15.93 58.08 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.253 -0.905 . . . . 0.0 109.968 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.56 HG21 HD11 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -81.31 -31.4 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 109.653 179.751 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.561 ' CZ3' ' HB2' ' A' ' 102' ' ' ALA . 11.1 m95 -75.07 -46.13 36.84 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.287 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.449 ' O ' ' OD1' ' A' ' 65' ' ' ASN . 11.4 mtpt -59.56 -53.18 61.01 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.278 -0.889 . . . . 0.0 109.981 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 85.8 mmt-85 -65.81 -9.63 30.36 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -0.884 . . . . 0.0 109.954 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.649 HD21 HD11 ' A' ' 106' ' ' LEU . 7.0 mt -88.53 -20.63 24.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.35 -0.844 . . . . 0.0 110.44 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.505 ' O ' ' ND2' ' A' ' 65' ' ' ASN . 2.4 p-10 -107.08 38.3 2.15 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.202 -0.936 . . . . 0.0 110.351 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.466 ' O ' ' O ' ' A' ' 65' ' ' ASN . 0.6 OUTLIER -55.45 -162.54 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.31 -0.869 . . . . 0.0 110.45 -179.789 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -122.31 -166.51 1.42 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.257 -0.902 . . . . 0.0 110.327 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -86.79 51.88 4.37 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -138.56 -36.73 0.56 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.402 -1.058 . . . . 0.0 110.106 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -144.0 54.2 1.3 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.413 -0.804 . . . . 0.0 110.136 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.42 ' NE1' ' HG3' ' A' ' 119' ' ' GLN . 65.6 p-90 -54.74 -17.55 3.6 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.288 -0.883 . . . . 0.0 110.171 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.36 -38.02 18.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.235 -0.916 . . . . 0.0 109.935 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.405 ' ND1' ' N ' ' A' ' 73' ' ' HIS . 2.5 m-70 -61.8 -41.33 97.61 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.353 -0.842 . . . . 0.0 109.861 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.545 ' CG1' HD22 ' A' ' 106' ' ' LEU . 28.7 t -58.08 -52.34 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.481 -0.762 . . . . 0.0 110.076 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.428 ' HB2' HG21 ' A' ' 123' ' ' VAL . 8.5 t80 -49.92 -53.18 27.68 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.335 -0.853 . . . . 0.0 110.15 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 4.9 mmtt -64.03 -25.55 68.17 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.246 -0.909 . . . . 0.0 110.107 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB1' ' CD2' ' A' ' 64' ' ' LEU . . . -73.38 -23.83 60.23 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.262 -0.899 . . . . 0.0 110.026 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.538 ' HE1' HG11 ' A' ' 74' ' ' VAL . 0.7 OUTLIER -77.12 -41.42 42.03 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.232 -0.917 . . . . 0.0 109.815 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.5 m -58.03 -55.7 31.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.463 -0.773 . . . . 0.0 110.062 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.541 ' CD2' HD12 ' A' ' 60' ' ' ILE . 31.8 tp -50.84 -57.63 7.98 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.367 -0.833 . . . . 0.0 109.784 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.513 ' HE2' ' CD1' ' A' ' 64' ' ' LEU . 1.8 ttp -47.29 -32.57 4.8 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.244 -0.91 . . . . 0.0 110.225 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.527 ' CA ' HD13 ' A' ' 130' ' ' LEU . 0.8 OUTLIER -75.17 -68.21 0.58 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.192 -0.943 . . . . 0.0 110.589 -179.908 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.456 ' O ' HG22 ' A' ' 87' ' ' THR . 48.7 t80 -40.33 -37.25 0.64 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 111.027 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.561 HD23 ' HB2' ' A' ' 44' ' ' ALA . 52.7 mt -76.09 -40.18 53.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.175 -0.953 . . . . 0.0 110.548 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.527 HG23 ' CD1' ' A' ' 134' ' ' LEU . 20.4 mt -53.47 -27.41 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 120.974 -1.079 . . . . 0.0 110.186 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.82 -74.78 0.49 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.121 -0.987 . . . . 0.0 110.422 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.469 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 11.2 t -86.06 -22.31 27.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.251 -0.905 . . . . 0.0 110.336 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.568 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -43.87 -74.06 0.22 Allowed Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.443 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 3.1 t 172.25 160.75 0.11 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.151 -1.205 . . . . 0.0 110.293 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.07 -19.5 32.26 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.27 -0.894 . . . . 0.0 110.087 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -76.52 -38.12 55.65 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.273 -0.892 . . . . 0.0 110.187 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.535 HG21 HG23 ' A' ' 47' ' ' THR . 71.6 t -60.01 -28.07 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.291 -0.881 . . . . 0.0 110.084 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.4 p -86.06 -38.54 17.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.234 -0.916 . . . . 0.0 110.162 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -58.84 -57.49 12.8 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.292 -0.88 . . . . 0.0 109.98 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.439 ' HG2' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -52.75 -35.74 56.72 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.4 -0.813 . . . . 0.0 109.875 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.495 ' O ' ' N ' ' A' ' 100' ' ' MET . 0.7 OUTLIER -59.55 -43.42 93.54 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.328 -0.858 . . . . 0.0 109.778 179.587 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -66.6 -35.93 81.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.322 179.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -80.84 -10.05 59.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.498 -0.752 . . . . 0.0 109.721 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -135.64 26.87 3.38 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.43 -0.794 . . . . 0.0 109.848 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.495 ' N ' ' O ' ' A' ' 96' ' ' CYS . 0.2 OUTLIER -61.53 -29.83 70.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.354 -0.841 . . . . 0.0 109.917 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -57.82 -27.31 63.03 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.329 -0.857 . . . . 0.0 109.816 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.561 ' HB2' ' CZ3' ' A' ' 61' ' ' TRP . . . -72.13 -41.52 67.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.41 -0.806 . . . . 0.0 110.043 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.475 HG13 ' CG2' ' A' ' 131' ' ' VAL . 3.3 t -76.9 -19.92 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.364 -0.835 . . . . 0.0 109.946 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.432 ' O ' ' HG3' ' A' ' 107' ' ' LYS . 1.1 mt-30 -91.28 -23.75 20.06 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.276 -0.89 . . . . 0.0 110.124 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.515 HG21 ' N ' ' A' ' 106' ' ' LEU . 7.7 t -75.85 -24.31 55.76 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.252 -0.905 . . . . 0.0 110.098 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.649 HD11 HD21 ' A' ' 64' ' ' LEU . 10.0 mt -61.05 -42.67 98.92 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.262 -0.899 . . . . 0.0 109.967 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.511 ' HA ' ' CA ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -59.74 -22.75 62.49 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.198 -0.939 . . . . 0.0 110.014 179.762 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -97.88 -17.97 18.97 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.304 -0.872 . . . . 0.0 110.189 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.488 ' C ' ' CD1' ' A' ' 109' ' ' PHE . 1.4 t80 -67.15 91.77 0.24 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.224 -0.922 . . . . 0.0 110.013 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.432 ' O ' ' HB2' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -97.94 135.8 39.14 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.34 -0.85 . . . . 0.0 110.255 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.432 ' HB2' ' O ' ' A' ' 110' ' ' GLN . 0.3 OUTLIER -178.19 115.41 0.08 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.278 -0.889 . . . . 0.0 110.163 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.418 ' O ' ' CG1' ' A' ' 112' ' ' VAL . 98.1 t -109.96 57.82 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.271 -0.893 . . . . 0.0 110.182 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.9 t70 51.29 -138.79 1.02 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.19 -0.943 . . . . 0.0 110.101 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.506 ' N ' ' CD ' ' A' ' 114' ' ' ARG . 0.0 OUTLIER -89.58 -65.94 0.97 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.192 -0.943 . . . . 0.0 109.447 179.76 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -124.18 36.1 4.69 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.558 -0.714 . . . . 0.0 110.118 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.412 ' CA ' HG12 ' A' ' 112' ' ' VAL . . . -65.86 -153.59 0.19 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.47 ' O ' ' O ' ' A' ' 118' ' ' ASP . 2.1 ttpm? -155.95 87.12 1.06 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.291 -1.123 . . . . 0.0 110.296 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.47 ' O ' ' O ' ' A' ' 117' ' ' LYS . 1.7 t70 39.41 94.96 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.476 -0.765 . . . . 0.0 110.736 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.42 ' HG3' ' NE1' ' A' ' 71' ' ' TRP . 12.9 pt20 -143.34 10.91 1.7 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.151 -0.968 . . . . 0.0 110.442 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.435 ' O ' ' HB ' ' A' ' 123' ' ' VAL . . . -104.38 -3.95 43.94 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.511 ' O ' ' N ' ' A' ' 123' ' ' VAL . 6.6 t -43.01 -73.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.279 -1.13 . . . . 0.0 111.031 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.524 ' O ' ' CB ' ' A' ' 126' ' ' LYS . 16.2 m-80 -33.63 -33.54 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.766 -0.583 . . . . 0.0 111.197 -178.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.534 ' CG1' HG12 ' A' ' 74' ' ' VAL . 1.7 t -77.58 -49.2 22.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.916 -1.115 . . . . 0.0 109.703 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.511 ' CA ' ' HA ' ' A' ' 107' ' ' LYS . 10.9 mtm-85 -60.79 -56.6 19.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.109 -0.995 . . . . 0.0 110.732 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -62.1 -51.11 69.22 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.271 -0.893 . . . . 0.0 110.956 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 122' ' ' ASN . 0.6 OUTLIER -50.43 -48.32 56.31 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.012 -1.055 . . . . 0.0 110.255 -179.688 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.42 ' HB3' ' HE2' ' A' ' 78' ' ' MET . . . -55.19 -46.04 75.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.36 -0.838 . . . . 0.0 110.591 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -62.12 -35.48 78.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.115 -0.991 . . . . 0.0 110.414 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -60.36 -51.48 69.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -0.913 . . . . 0.0 110.555 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.527 HD13 ' CA ' ' A' ' 82' ' ' GLU . 2.1 tt -53.9 -36.76 63.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.14 -0.975 . . . . 0.0 110.295 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.475 ' CG2' HG13 ' A' ' 103' ' ' VAL . 76.5 t -74.87 -27.1 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.353 -0.842 . . . . 0.0 110.144 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 136' ' ' ASP . . . -68.42 -51.5 43.16 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.374 -0.829 . . . . 0.0 110.576 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.456 HD11 HD11 ' A' ' 134' ' ' LEU . 2.2 pp -63.83 -26.04 68.44 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.202 -0.936 . . . . 0.0 110.384 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.527 ' CD1' HG23 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -87.62 -13.69 42.05 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.268 -0.895 . . . . 0.0 110.106 179.881 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -156.53 83.85 0.97 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.338 -0.851 . . . . 0.0 110.155 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 132' ' ' ALA . 6.6 t70 -122.02 -22.94 5.52 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.299 -0.875 . . . . 0.0 110.444 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -57.44 104.49 0.18 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.147 -0.97 . . . . 0.0 110.217 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -143.76 76.49 1.52 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.267 -0.896 . . . . 0.0 110.206 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -52.13 -60.84 2.73 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.271 -0.893 . . . . 0.0 110.249 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.1 mp -81.62 161.65 23.39 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.35 -0.844 . . . . 0.0 110.203 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -91.06 84.92 5.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.285 -0.884 . . . . 0.0 110.183 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' A' ' 144' ' ' ARG . 2.6 mp0 -86.36 -47.75 9.08 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.22 -0.925 . . . . 0.0 110.111 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 47.84 -91.12 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.335 -0.853 . . . . 0.0 110.182 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 142' ' ' GLU . 1.3 tpt180 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.211 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 109.466 -1.453 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 20.6 p -65.72 132.15 48.07 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.284 -1.127 . . . . 0.0 110.202 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 4.7 t 56.61 -153.8 0.35 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.239 -0.913 . . . . 0.0 110.227 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . 0.524 ' O ' ' N ' ' A' ' 2' ' ' SER . 20.3 mtm105 -136.53 -154.47 0.56 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.273 -0.892 . . . . 0.0 110.182 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mtp 48.54 -90.5 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.295 -0.878 . . . . 0.0 110.237 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.524 ' N ' ' O ' ' A' ' 0' ' ' ARG . 54.8 p -162.69 172.91 14.58 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 110.173 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 p -106.77 -6.82 17.52 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.248 -0.908 . . . . 0.0 110.146 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 t 59.25 -172.98 0.11 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.287 -0.883 . . . . 0.0 110.119 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.5 m -122.74 174.6 7.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.183 -0.948 . . . . 0.0 110.223 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 mp -122.48 146.48 47.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.231 -0.918 . . . . 0.0 110.193 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.22 17.86 1.08 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.215 -0.928 . . . . 0.0 110.146 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -64.77 156.18 31.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.31 -0.869 . . . . 0.0 110.26 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -101.45 150.47 23.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.284 -0.885 . . . . 0.0 110.243 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.4 mmt -104.92 -63.46 1.22 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.285 -0.885 . . . . 0.0 110.188 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -66.16 171.64 4.5 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.331 -0.855 . . . . 0.0 110.225 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.414 ' O ' ' OD1' ' A' ' 12' ' ' ASN . 7.3 p30 -100.1 113.32 25.86 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.303 -0.873 . . . . 0.0 110.151 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 tt -98.78 1.34 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.305 -0.872 . . . . 0.0 110.322 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 31.5 t -74.23 104.96 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.191 -0.943 . . . . 0.0 110.237 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -148.33 146.84 28.72 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 110.299 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 -143.45 79.07 1.62 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.279 -0.888 . . . . 0.0 110.115 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.438 ' CD2' ' OE2' ' A' ' 19' ' ' GLU . 38.5 p90 -95.59 149.76 21.09 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.213 -0.929 . . . . 0.0 110.302 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.468 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 0.5 OUTLIER -126.57 -30.8 2.79 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.299 -0.876 . . . . 0.0 110.126 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 18' ' ' SER . 28.1 mt-10 56.28 17.44 2.83 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.274 -0.891 . . . . 0.0 110.422 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.492 ' CB ' HD12 ' A' ' 46' ' ' LEU . . . -67.85 -50.14 58.26 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.184 -0.947 . . . . 0.0 110.141 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.44 ' HG3' ' N ' ' A' ' 22' ' ' ILE . 16.7 pt-20 -49.21 -29.68 5.97 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.22 -0.925 . . . . 0.0 110.205 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.44 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 55.8 mt -74.71 -39.89 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.206 -0.934 . . . . 0.0 110.011 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.467 ' O ' HD11 ' A' ' 43' ' ' ILE . 14.7 mttp -70.66 -23.99 62.61 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.383 -0.823 . . . . 0.0 110.073 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.525 HG21 HG22 ' A' ' 56' ' ' ILE . 72.3 t -79.55 -34.1 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.249 -0.907 . . . . 0.0 110.152 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -40.38 87.73 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.296 -0.877 . . . . 0.0 110.263 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -44.12 54.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.335 -0.853 . . . . 0.0 110.176 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.518 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -57.06 -20.55 25.59 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.242 -0.911 . . . . 0.0 110.114 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.523 ' O ' ' CB ' ' A' ' 76' ' ' LYS . 2.5 p -93.1 -83.63 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.214 -0.929 . . . . 0.0 110.077 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.0 t -69.59 98.67 1.18 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.165 -0.959 . . . . 0.0 110.196 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -106.8 29.19 7.23 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.316 -0.865 . . . . 0.0 110.235 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.582 ' N ' ' CD ' ' A' ' 32' ' ' PRO . 0.4 OUTLIER -54.14 -48.12 95.21 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.28 -0.888 . . . . 0.0 110.157 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.582 ' CD ' ' N ' ' A' ' 31' ' ' ASP . 37.1 Cg_exo -56.27 174.69 0.32 Allowed 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.018 1.536 . . . . 0.0 110.334 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -102.11 -177.47 3.42 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.265 -0.897 . . . . 0.0 110.519 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 136.09 149.27 5.7 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -67.6 177.54 3.97 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 O-C-N 124.056 1.556 . . . . 0.0 110.526 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.7 m -132.1 152.06 51.43 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.329 -0.857 . . . . 0.0 109.99 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.403 ' O ' ' HB2' ' A' ' 38' ' ' SER . 0.4 OUTLIER -143.23 -59.2 0.42 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.231 -0.918 . . . . 0.0 110.355 -179.875 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.403 ' HB2' ' O ' ' A' ' 37' ' ' SER . 5.0 t 176.21 53.25 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.203 -0.935 . . . . 0.0 110.121 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.518 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 13.1 tp -65.07 -35.18 80.33 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.248 -0.908 . . . . 0.0 110.333 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.402 ' HE3' HG23 ' A' ' 79' ' ' THR . 0.0 OUTLIER -63.09 -42.61 99.65 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.15 -0.969 . . . . 0.0 110.316 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.466 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.3 OUTLIER -61.53 -33.46 73.86 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.118 -0.989 . . . . 0.0 110.193 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.08 -44.23 60.79 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.195 -0.94 . . . . 0.0 110.0 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.507 ' CG2' HD12 ' A' ' 80' ' ' LEU . 85.4 mt -59.64 -31.34 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.192 -0.942 . . . . 0.0 110.021 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.539 ' CA ' ' CD2' ' A' ' 84' ' ' LEU . . . -72.58 -52.79 14.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.924 . . . . 0.0 109.522 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.435 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 27.9 t0 -51.52 -22.39 3.14 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.988 -1.07 . . . . 0.0 108.679 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.492 HD12 ' CB ' ' A' ' 20' ' ' ALA . 15.1 mt -77.68 -40.64 40.8 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.593 -0.692 . . . . 0.0 109.908 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.533 HG22 HG21 ' A' ' 92' ' ' VAL . 68.0 p -49.64 -42.95 46.4 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.154 -0.967 . . . . 0.0 109.407 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.545 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 85.3 m-85 -44.88 -45.37 10.25 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.241 -0.912 . . . . 0.0 109.486 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.534 ' O ' ' N ' ' A' ' 51' ' ' VAL . 3.4 t-20 -71.47 92.65 1.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.511 -0.743 . . . . 0.0 110.331 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.523 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.75 -56.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.863 178.301 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.549 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.8 t -64.21 -65.7 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 120.954 -1.091 . . . . 0.0 110.495 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.549 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -37.51 -45.01 0.7 Allowed 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 121.169 0.509 . . . . 0.0 110.972 -177.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.575 ' CE1' HG23 ' A' ' 92' ' ' VAL . 16.7 t80 -60.19 -53.82 53.14 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.32 -0.862 . . . . 0.0 110.425 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 58' ' ' SER . 9.2 t -56.62 -21.07 24.46 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.221 -0.924 . . . . 0.0 110.152 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -93.75 -22.46 18.69 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -0.894 . . . . 0.0 110.368 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.525 HG22 HG21 ' A' ' 24' ' ' VAL . 30.1 mt -81.67 -55.95 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.242 -0.911 . . . . 0.0 110.203 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.558 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 90.8 mmm -58.6 -36.12 73.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.196 -0.94 . . . . 0.0 109.705 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 54' ' ' SER . 0.3 OUTLIER -59.02 -55.3 36.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.332 -0.855 . . . . 0.0 109.801 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.439 ' CB ' HG13 ' A' ' 24' ' ' VAL . 3.0 mmt -63.29 -25.08 68.15 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.225 -0.922 . . . . 0.0 109.766 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.571 HG21 HD13 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -73.67 -31.0 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.519 -0.738 . . . . 0.0 109.824 179.817 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.494 ' CE3' HD12 ' A' ' 64' ' ' LEU . 16.4 m95 -76.39 -56.99 4.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.127 -0.983 . . . . 0.0 110.143 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.13 -50.84 10.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.247 -0.908 . . . . 0.0 110.214 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -68.38 -31.87 71.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.212 -0.93 . . . . 0.0 110.151 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.699 HD22 HD12 ' A' ' 106' ' ' LEU . 7.4 mt -65.25 -26.82 68.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.29 -0.882 . . . . 0.0 110.054 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -101.15 36.52 1.97 Allowed 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.338 -0.851 . . . . 0.0 109.933 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.483 ' O ' ' HB3' ' A' ' 67' ' ' HIS . 2.0 t70 -66.82 177.95 1.5 Allowed 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.46 -0.775 . . . . 0.0 110.094 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.483 ' HB3' ' O ' ' A' ' 66' ' ' ASP . 24.7 p80 178.79 178.54 0.43 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.501 -0.75 . . . . 0.0 110.179 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.413 ' O ' ' C ' ' A' ' 69' ' ' LYS . . . 59.55 -88.15 0.02 OUTLIER Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.413 ' C ' ' O ' ' A' ' 68' ' ' GLY . 8.9 mmtt -43.68 -87.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.122 -1.223 . . . . 0.0 110.186 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -159.24 149.49 19.22 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.394 -0.816 . . . . 0.0 110.325 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.402 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 51.2 p-90 -80.37 7.1 10.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.264 -0.898 . . . . 0.0 110.118 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.54 -37.74 58.29 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.264 -0.897 . . . . 0.0 110.215 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.452 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 1.5 m-70 -68.04 -32.03 72.11 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.303 -0.873 . . . . 0.0 110.204 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.598 ' CG1' ' CG2' ' A' ' 123' ' ' VAL . 27.1 t -64.71 -59.4 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.196 -0.94 . . . . 0.0 110.2 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -47.02 -53.42 12.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.266 -0.896 . . . . 0.0 109.936 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -59.27 -33.07 70.61 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.239 -0.913 . . . . 0.0 109.63 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.532 ' HB2' HD21 ' A' ' 64' ' ' LEU . . . -66.71 -28.85 68.76 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.287 -0.883 . . . . 0.0 109.645 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.5 ' HE1' HG12 ' A' ' 74' ' ' VAL . 1.8 mtt -71.0 -32.92 69.86 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.282 -0.886 . . . . 0.0 109.923 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.402 HG23 ' HE3' ' A' ' 40' ' ' MET . 8.0 m -67.87 -37.1 81.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.326 -0.859 . . . . 0.0 110.307 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.527 ' CD1' HD11 ' A' ' 84' ' ' LEU . 23.1 tp -73.06 -37.85 66.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.213 -0.929 . . . . 0.0 110.022 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.533 ' HG2' ' CD2' ' A' ' 130' ' ' LEU . 3.2 ttt -73.61 -27.0 61.06 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.173 -0.955 . . . . 0.0 109.946 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.538 ' CA ' HD12 ' A' ' 130' ' ' LEU . 1.8 tt0 -80.05 -37.67 33.5 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 110.015 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.466 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 37.1 t80 -72.7 -46.06 55.64 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.386 -0.821 . . . . 0.0 110.349 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.539 ' CD2' ' CA ' ' A' ' 44' ' ' ALA . 76.3 mt -66.63 -43.54 84.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.266 -0.896 . . . . 0.0 110.34 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.547 ' CD1' HD21 ' A' ' 130' ' ' LEU . 8.6 mt -53.41 -19.32 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.107 -0.996 . . . . 0.0 109.681 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -96.22 -79.32 0.45 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.272 -0.893 . . . . 0.0 110.18 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.463 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 10.2 t -80.08 -23.63 41.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.221 -0.924 . . . . 0.0 110.288 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.545 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -43.97 -71.11 0.48 Allowed Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.466 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.6 OUTLIER 171.78 160.59 0.1 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.203 -1.175 . . . . 0.0 110.174 179.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -59.61 -16.17 23.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.219 -0.925 . . . . 0.0 110.093 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.0 mmt180 -79.79 -40.97 27.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.281 -0.887 . . . . 0.0 110.323 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.575 HG23 ' CE1' ' A' ' 53' ' ' PHE . 53.1 t -57.91 -38.17 64.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.151 -0.968 . . . . 0.0 109.933 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.2 m -71.49 -42.69 67.73 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.177 -0.952 . . . . 0.0 109.779 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -56.13 -39.73 72.7 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.287 -0.883 . . . . 0.0 109.777 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.488 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 3.9 tt0 -68.64 -38.02 80.17 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.376 -0.827 . . . . 0.0 109.296 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.443 ' SG ' HD21 ' A' ' 134' ' ' LEU . 51.8 t -58.1 -28.62 64.78 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.028 -1.045 . . . . 0.0 108.807 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -87.2 -20.99 26.15 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.519 -0.738 . . . . 0.0 110.04 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.1 pt-20 -84.52 -20.01 32.3 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.104 -0.998 . . . . 0.0 109.932 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -124.7 44.49 2.76 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.394 -0.816 . . . . 0.0 110.099 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.12 -34.73 76.9 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.247 -0.908 . . . . 0.0 110.106 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -59.94 -21.44 61.17 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.362 -0.836 . . . . 0.0 110.01 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.47 ' HA ' HG22 ' A' ' 105' ' ' THR . . . -82.46 -42.39 18.57 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.327 -0.858 . . . . 0.0 110.292 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.468 HG22 ' CZ3' ' A' ' 61' ' ' TRP . 2.6 t -75.06 -18.82 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.325 -0.859 . . . . 0.0 110.268 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.455 ' HG2' HG21 ' A' ' 131' ' ' VAL . 6.8 mm-40 -95.33 -27.77 15.3 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.212 -0.93 . . . . 0.0 110.649 -179.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.47 HG22 ' HA ' ' A' ' 102' ' ' ALA . 9.7 t -64.95 -14.67 60.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.089 -1.007 . . . . 0.0 110.094 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.699 HD12 HD22 ' A' ' 64' ' ' LEU . 8.9 mt -65.26 -34.23 77.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.356 -0.84 . . . . 0.0 110.197 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -13.4 51.71 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.343 -0.848 . . . . 0.0 110.428 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.444 ' O ' ' C ' ' A' ' 109' ' ' PHE . 2.1 t0 -90.36 -11.15 41.45 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.205 -0.934 . . . . 0.0 110.453 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.453 ' HB2' ' O ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -37.78 144.73 0.08 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.518 -0.739 . . . . 0.0 110.746 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.408 ' O ' ' HB2' ' A' ' 111' ' ' TYR . 8.0 mt-30 -138.44 123.27 18.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.237 -0.914 . . . . 0.0 110.045 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.408 ' HB2' ' O ' ' A' ' 110' ' ' GLN . 3.2 t80 -175.67 135.02 0.3 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.215 -0.928 . . . . 0.0 110.211 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.512 ' CG1' ' HA2' ' A' ' 116' ' ' GLY . 37.1 t -131.99 0.41 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.295 -0.878 . . . . 0.0 110.179 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.2 t0 49.41 -146.19 0.38 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.27 -0.894 . . . . 0.0 110.119 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.569 ' CG ' ' N ' ' A' ' 115' ' ' ASP . 9.8 ptt180 -97.59 -45.97 6.2 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.257 -0.902 . . . . 0.0 109.95 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.569 ' N ' ' CG ' ' A' ' 114' ' ' ARG . 12.1 t70 -40.24 -27.95 0.05 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.593 -0.692 . . . . 0.0 110.36 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.512 ' HA2' ' CG1' ' A' ' 112' ' ' VAL . . . 88.4 -179.5 46.39 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.6 tttp 62.91 139.49 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.274 -1.133 . . . . 0.0 110.305 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.448 ' HA ' HG23 ' A' ' 112' ' ' VAL . 1.2 t70 -72.51 137.98 46.67 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.328 -0.857 . . . . 0.0 110.161 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -132.24 33.68 3.84 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.203 -0.936 . . . . 0.0 110.18 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -115.49 25.65 9.59 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.546 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p -78.06 -44.0 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.154 -1.204 . . . . 0.0 110.042 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.546 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.6 OUTLIER -49.08 -50.96 34.32 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.488 -0.758 . . . . 0.0 110.007 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.598 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 6.4 p -74.24 -20.61 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.072 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.448 ' HB3' ' O ' ' A' ' 121' ' ' VAL . 9.9 ttt180 -68.29 -65.29 0.72 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.153 -0.967 . . . . 0.0 110.392 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -62.07 -28.92 69.95 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.382 -0.824 . . . . 0.0 110.47 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -58.55 7.95 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.063 -1.023 . . . . 0.0 110.082 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -51.87 -40.27 60.35 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.202 -0.936 . . . . 0.0 110.0 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -63.36 -36.85 85.09 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.282 -0.886 . . . . 0.0 110.375 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.49 -49.81 73.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.253 -0.904 . . . . 0.0 110.404 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.547 HD21 ' CD1' ' A' ' 85' ' ' ILE . 0.9 OUTLIER -56.98 -28.84 62.73 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.963 -1.086 . . . . 0.0 109.654 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.458 HG22 HG11 ' A' ' 103' ' ' VAL . 55.7 t -78.53 -27.78 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.282 -0.886 . . . . 0.0 109.728 179.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -75.61 -57.41 3.9 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.378 -0.826 . . . . 0.0 110.374 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.95 -34.85 4.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.218 -0.926 . . . . 0.0 110.446 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.484 ' CD1' ' O ' ' A' ' 130' ' ' LEU . 0.4 OUTLIER -83.06 -33.65 26.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.134 -0.979 . . . . 0.0 110.394 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -119.28 102.66 8.86 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.165 -0.959 . . . . 0.0 110.189 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -151.98 -78.15 0.12 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.2 -0.938 . . . . 0.0 110.269 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -157.49 147.36 20.46 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.25 -0.906 . . . . 0.0 110.303 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -60.98 87.87 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.337 -0.852 . . . . 0.0 110.354 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.71 93.04 8.7 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.295 -0.878 . . . . 0.0 110.253 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.8 mt -112.7 -82.92 0.59 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.179 -0.951 . . . . 0.0 110.178 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.63 149.06 42.03 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.256 -0.902 . . . . 0.0 110.17 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.36 64.77 1.25 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.893 . . . . 0.0 110.119 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -92.64 -84.68 0.28 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.334 -0.853 . . . . 0.0 110.294 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 6.8 ttt-85 . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.257 -179.874 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 50.3 m -152.72 147.84 26.56 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.161 -1.2 . . . . 0.0 110.346 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 1.8 m -143.8 -55.19 0.37 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.377 -0.827 . . . . 0.0 110.137 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.5 -78.93 0.48 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.207 -0.933 . . . . 0.0 110.234 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 ptp -114.49 169.3 9.15 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.281 -0.887 . . . . 0.0 110.141 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -179.11 -171.8 0.22 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.285 -0.884 . . . . 0.0 110.32 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 99.3 m -50.69 104.4 0.07 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.322 -0.861 . . . . 0.0 110.21 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.3 p -156.5 102.4 2.07 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.247 -0.908 . . . . 0.0 110.165 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.5 p -105.21 176.92 5.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.224 -0.922 . . . . 0.0 110.262 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.0 mt -94.34 145.25 24.89 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.231 -0.918 . . . . 0.0 110.255 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.32 85.17 5.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.888 . . . . 0.0 110.2 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.87 -24.9 8.43 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.276 -0.89 . . . . 0.0 110.219 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -91.89 105.19 17.51 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.255 -0.903 . . . . 0.0 110.188 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 29.8 mtp -106.38 -151.54 0.46 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.306 -0.871 . . . . 0.0 110.142 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.2 ptmt -52.09 154.46 2.27 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.264 -0.897 . . . . 0.0 110.269 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -115.43 -178.2 3.32 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.276 -0.89 . . . . 0.0 110.182 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 98.1 mt -61.14 121.49 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.308 -0.87 . . . . 0.0 110.269 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.447 ' O ' ' C ' ' A' ' 15' ' ' HIS . 2.9 m -123.52 144.86 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.292 -0.88 . . . . 0.0 110.196 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.447 ' C ' ' O ' ' A' ' 14' ' ' VAL . 5.1 t60 38.49 63.92 0.81 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.494 -0.754 . . . . 0.0 110.633 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -53.1 162.74 0.62 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.218 -0.926 . . . . 0.0 110.219 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -104.44 172.07 6.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.217 -0.927 . . . . 0.0 110.09 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 61.41 68.03 0.74 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.25 -0.906 . . . . 0.0 110.144 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -124.65 -3.65 7.77 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.27 -0.894 . . . . 0.0 110.29 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.458 ' HA ' HD11 ' A' ' 46' ' ' LEU . . . -58.42 -50.34 74.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.152 -0.968 . . . . 0.0 110.133 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' A' ' 20' ' ' ALA . 8.0 pt-20 -43.23 -29.64 0.41 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.27 -0.893 . . . . 0.0 110.08 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.7 mt -82.59 -43.13 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.238 -0.914 . . . . 0.0 110.073 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.49 ' O ' ' CD1' ' A' ' 39' ' ' LEU . 8.0 mmtm -57.11 -32.34 66.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.311 -0.868 . . . . 0.0 110.111 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.563 HG21 HG21 ' A' ' 56' ' ' ILE . 87.0 t -76.34 -43.6 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.986 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.18 -39.22 74.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.316 -0.865 . . . . 0.0 110.126 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -83.18 -29.48 28.53 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.393 -0.817 . . . . 0.0 110.154 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.515 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . . . -62.14 -25.05 67.52 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.299 -0.876 . . . . 0.0 110.014 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.484 ' CA ' ' HB3' ' A' ' 76' ' ' LYS . 28.3 p -100.84 33.77 2.69 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.259 -0.901 . . . . 0.0 110.111 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 34.0 t -167.58 105.87 0.53 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 0.0 110.183 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -174.15 167.98 4.1 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.249 -0.907 . . . . 0.0 110.204 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -86.87 147.95 44.46 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.313 -0.867 . . . . 0.0 110.176 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.45 ' O ' ' CB ' ' A' ' 33' ' ' TRP . 35.2 Cg_exo -56.09 -174.99 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 123.982 1.517 . . . . 0.0 110.275 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.45 ' CB ' ' O ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER 66.09 174.54 0.23 Allowed 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.212 -0.93 . . . . 0.0 110.497 -179.879 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 113.92 95.94 2.15 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -62.57 -34.34 75.3 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 124.006 1.529 . . . . 0.0 110.262 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.4 p -114.6 146.98 40.16 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 110.057 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.419 ' O ' ' OG ' ' A' ' 37' ' ' SER . 1.4 p -152.71 113.07 4.04 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.264 -0.898 . . . . 0.0 110.268 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.08 61.48 0.61 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.276 -0.89 . . . . 0.0 110.047 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.515 ' CD1' ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -131.46 -39.71 1.13 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.217 -0.927 . . . . 0.0 110.318 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.412 ' HE3' HG21 ' A' ' 79' ' ' THR . 8.2 mmm -75.84 -60.67 2.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.235 -0.916 . . . . 0.0 110.464 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 86.0 p -48.93 -29.33 4.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.167 -0.958 . . . . 0.0 110.366 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -74.36 -53.5 9.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.264 -0.897 . . . . 0.0 110.403 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.527 ' CG2' HD12 ' A' ' 80' ' ' LEU . 44.4 mt -53.52 -39.62 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -0.925 . . . . 0.0 110.112 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.513 ' HA ' ' CD2' ' A' ' 84' ' ' LEU . . . -66.36 -51.08 60.78 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.076 -1.015 . . . . 0.0 109.168 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.449 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -56.22 -19.33 13.37 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.088 -1.008 . . . . 0.0 108.862 178.874 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.486 ' HB2' ' O ' ' A' ' 43' ' ' ILE . 13.5 mt -82.76 -38.53 23.08 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.572 -0.705 . . . . 0.0 110.092 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.513 ' HA ' ' CA ' ' A' ' 53' ' ' PHE . 61.7 p -51.75 -43.28 62.86 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.078 -1.014 . . . . 0.0 109.223 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.455 ' OH ' ' O ' ' A' ' 87' ' ' THR . 88.3 m-85 -43.18 -43.41 4.64 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.475 -0.765 . . . . 0.0 109.485 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.543 ' O ' ' N ' ' A' ' 51' ' ' VAL . 2.6 t-20 -73.17 93.44 1.84 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.558 -0.714 . . . . 0.0 110.328 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.519 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.95 -56.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.908 178.37 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.555 HG13 ' N ' ' A' ' 52' ' ' ALA . 3.1 t -66.19 -66.29 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.044 -1.035 . . . . 0.0 110.701 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.555 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -37.64 -46.09 0.84 Allowed 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.022 -177.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.559 ' CD1' HG21 ' A' ' 92' ' ' VAL . 3.1 t80 -56.44 -53.91 51.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.29 -0.881 . . . . 0.0 110.037 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.2 m -57.18 -21.83 36.09 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.144 -0.973 . . . . 0.0 110.025 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -88.95 -24.64 22.38 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.357 -0.839 . . . . 0.0 110.189 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.563 HG21 HG21 ' A' ' 24' ' ' VAL . 4.1 mt -79.15 -70.32 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.405 -0.809 . . . . 0.0 110.229 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.475 ' HE1' ' CZ2' ' A' ' 61' ' ' TRP . 5.0 mtp -46.17 -38.33 8.15 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.221 -0.925 . . . . 0.0 109.772 179.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -54.69 -62.08 1.89 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.358 -0.838 . . . . 0.0 110.048 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.455 ' HB3' HG12 ' A' ' 24' ' ' VAL . 0.0 OUTLIER -58.69 -23.11 58.86 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.969 179.786 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.571 HG23 HD12 ' A' ' 64' ' ' LEU . 0.3 OUTLIER -73.95 -31.75 31.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.295 -0.878 . . . . 0.0 109.834 179.718 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.547 ' CE3' HD11 ' A' ' 64' ' ' LEU . 14.0 m95 -76.29 -63.44 1.33 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.138 -0.976 . . . . 0.0 110.265 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -44.83 -45.43 10.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.297 -0.877 . . . . 0.0 110.405 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -69.69 -34.15 73.52 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.286 -0.884 . . . . 0.0 110.386 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.624 HD21 ' CD1' ' A' ' 106' ' ' LEU . 7.5 mt -57.51 -20.52 31.99 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.221 -0.925 . . . . 0.0 110.42 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.457 ' O ' ' O ' ' A' ' 66' ' ' ASP . 3.4 m120 -107.44 39.88 1.81 Allowed 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.252 -0.905 . . . . 0.0 110.136 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.464 ' OD2' ' HB2' ' A' ' 73' ' ' HIS . 1.7 t0 -55.05 -163.16 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.302 -0.874 . . . . 0.0 110.356 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.47 -176.08 5.94 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.347 -0.846 . . . . 0.0 110.257 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.476 ' HA3' ' CD2' ' A' ' 111' ' ' TYR . . . -72.75 -56.73 5.77 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -70.33 -23.4 62.82 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.254 -1.145 . . . . 0.0 110.312 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.458 ' O ' ' OD2' ' A' ' 66' ' ' ASP . 40.0 m-20 -96.38 47.57 1.08 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.317 -0.864 . . . . 0.0 110.501 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.523 ' CE2' ' CD ' ' A' ' 119' ' ' GLN . 47.7 p-90 -77.3 -11.02 59.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.228 -0.92 . . . . 0.0 110.228 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.76 -28.52 22.68 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.262 -0.899 . . . . 0.0 110.018 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.47 ' O ' ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -78.1 -35.12 49.65 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.269 -0.894 . . . . 0.0 110.021 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.588 ' CG1' ' CG2' ' A' ' 123' ' ' VAL . 13.3 t -60.65 -55.31 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.338 -0.851 . . . . 0.0 109.758 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -52.48 -52.85 52.26 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.35 -0.844 . . . . 0.0 109.874 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.484 ' HB3' ' CA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -61.13 -24.84 66.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.314 -0.866 . . . . 0.0 109.991 179.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.55 ' HB1' ' CD2' ' A' ' 64' ' ' LEU . . . -74.64 -34.02 62.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.309 -0.869 . . . . 0.0 109.997 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.554 ' HE3' HG12 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -66.87 -30.87 71.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.371 -0.831 . . . . 0.0 109.462 179.513 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.412 HG21 ' HE3' ' A' ' 40' ' ' MET . 3.2 m -66.73 -64.05 0.94 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.499 -0.75 . . . . 0.0 109.946 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.535 ' CD2' HD13 ' A' ' 60' ' ' ILE . 29.9 tp -46.87 -46.81 21.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.322 -0.861 . . . . 0.0 110.135 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.523 ' HE2' ' CZ2' ' A' ' 61' ' ' TRP . 19.6 ttm -56.53 -42.99 79.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.114 -0.991 . . . . 0.0 110.205 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.448 ' O ' ' C ' ' A' ' 83' ' ' TYR . 62.6 tt0 -68.49 -65.91 0.64 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.243 -0.91 . . . . 0.0 110.336 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.465 ' CE2' HG21 ' A' ' 87' ' ' THR . 57.9 t80 -37.52 -47.78 0.94 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.454 -0.779 . . . . 0.0 110.791 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.527 ' CB ' HG11 ' A' ' 92' ' ' VAL . 68.4 mt -68.03 -43.93 77.64 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.842 . . . . 0.0 110.222 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.561 ' N ' HG13 ' A' ' 92' ' ' VAL . 23.5 mt -47.9 -29.54 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.033 -1.042 . . . . 0.0 109.75 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.63 -72.6 0.61 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.326 -0.859 . . . . 0.0 110.111 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.465 HG21 ' CE2' ' A' ' 83' ' ' TYR . 8.0 t -83.8 -27.44 28.8 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.278 -0.889 . . . . 0.0 110.108 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.462 ' CA ' ' HA ' ' A' ' 84' ' ' LEU . . . -44.16 -85.83 0.01 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.465 ' O ' ' HB ' ' A' ' 92' ' ' VAL . 1.3 t -175.78 154.44 1.54 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -1.184 . . . . 0.0 110.382 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -47.68 -44.98 27.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.247 -0.908 . . . . 0.0 110.615 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -59.47 -43.43 93.24 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.42 -0.8 . . . . 0.0 110.199 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.561 HG13 ' N ' ' A' ' 85' ' ' ILE . 18.9 t -53.12 -25.55 9.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.483 0 O-C-N 121.318 -0.864 . . . . 0.0 109.85 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.0 t -91.2 -35.13 14.7 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 110.059 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -61.61 -53.01 61.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.294 -0.878 . . . . 0.0 110.018 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 11.2 tt0 -60.22 -38.52 83.63 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.332 -0.855 . . . . 0.0 109.254 179.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.44 ' SG ' HD12 ' A' ' 85' ' ' ILE . 0.1 OUTLIER -55.77 -30.19 60.88 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.104 -0.998 . . . . 0.0 109.016 179.144 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.53 -23.55 27.66 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.447 -0.783 . . . . 0.0 110.254 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 4.8 pt-20 -80.42 -21.5 42.14 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.189 -0.944 . . . . 0.0 109.635 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.54 41.13 2.9 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.494 -0.754 . . . . 0.0 109.836 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.445 ' HG3' ' N ' ' A' ' 101' ' ' TYR . 0.4 OUTLIER -61.04 -24.85 66.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.353 -0.842 . . . . 0.0 110.255 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.461 ' O ' ' HB ' ' A' ' 105' ' ' THR . 20.6 m-85 -68.67 -27.87 66.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.0 109.673 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.519 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -75.64 -43.62 46.85 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.439 -0.788 . . . . 0.0 110.062 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.485 HG12 HG21 ' A' ' 131' ' ' VAL . 2.9 t -71.36 -29.03 33.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.413 -0.804 . . . . 0.0 110.042 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.466 ' HG2' HG23 ' A' ' 131' ' ' VAL . 0.3 OUTLIER -83.56 -28.59 28.47 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.215 -0.928 . . . . 0.0 110.362 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.519 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 7.1 t -60.84 -23.51 65.16 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.193 -0.942 . . . . 0.0 110.108 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.624 ' CD1' HD21 ' A' ' 64' ' ' LEU . 19.0 mt -65.06 -41.95 94.66 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.233 -0.917 . . . . 0.0 109.936 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.449 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 31.2 ttpt -48.09 -28.06 2.67 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.307 -0.871 . . . . 0.0 110.185 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -96.24 -26.7 15.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.366 -0.834 . . . . 0.0 110.259 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.68 110.64 0.75 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.247 -0.908 . . . . 0.0 110.227 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.32 141.55 29.83 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 110.198 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.478 ' CE1' ' OD1' ' A' ' 113' ' ' ASP . 0.2 OUTLIER -166.88 109.03 0.68 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.234 -0.917 . . . . 0.0 110.143 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.448 ' O ' ' HA3' ' A' ' 116' ' ' GLY . 59.1 t -117.16 -1.69 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.191 -0.943 . . . . 0.0 110.435 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.478 ' OD1' ' CE1' ' A' ' 111' ' ' TYR . 0.6 OUTLIER 53.89 169.85 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.266 -0.896 . . . . 0.0 110.293 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -51.03 -47.96 61.57 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.266 -0.896 . . . . 0.0 110.293 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -117.9 86.51 2.54 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.265 -0.897 . . . . 0.0 110.138 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.448 ' HA3' ' O ' ' A' ' 112' ' ' VAL . . . -136.97 -170.5 11.93 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 24.1 mtmm -112.74 120.22 40.74 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.152 -1.204 . . . . 0.0 110.151 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 59.5 t0 -58.16 101.68 0.09 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.233 -0.917 . . . . 0.0 110.105 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.523 ' CD ' ' CE2' ' A' ' 71' ' ' TRP . 4.7 pp0? -141.81 10.7 2.01 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.317 -0.864 . . . . 0.0 110.325 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.518 ' O ' ' CB ' ' A' ' 124' ' ' ARG . . . -59.8 -14.91 32.16 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.473 ' O ' ' C ' ' A' ' 122' ' ' ASN . 32.4 t -66.21 -76.92 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -1.079 . . . . 0.0 111.422 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.498 ' O ' ' CB ' ' A' ' 126' ' ' LYS . 14.5 m120 -33.01 -55.62 0.39 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.733 -0.604 . . . . 0.0 111.414 -178.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.588 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 9.9 p -66.69 -39.7 84.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 120.852 -1.155 . . . . 0.0 109.904 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.518 ' CB ' ' O ' ' A' ' 120' ' ' GLY . 8.9 ttp180 -62.03 -70.9 0.17 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.167 -0.958 . . . . 0.0 110.634 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.403 ' N ' ' HG2' ' A' ' 124' ' ' ARG . 21.8 mt-10 -55.2 -28.67 54.68 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.241 -0.912 . . . . 0.0 110.656 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.498 ' CB ' ' O ' ' A' ' 122' ' ' ASN . 6.1 tptp -62.35 -62.4 1.78 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.092 -1.005 . . . . 0.0 109.578 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.419 ' HB3' ' SD ' ' A' ' 78' ' ' MET . . . -47.7 -40.87 21.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.356 -0.84 . . . . 0.0 110.004 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.26 -40.31 89.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.215 -0.928 . . . . 0.0 110.381 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -54.22 26.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.205 -0.934 . . . . 0.0 110.479 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.52 HD13 ' CD1' ' A' ' 85' ' ' ILE . 11.7 tp -46.95 -28.98 1.81 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.171 -0.956 . . . . 0.0 109.929 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.485 HG21 HG12 ' A' ' 103' ' ' VAL . 28.8 t -79.98 -38.77 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.347 -0.846 . . . . 0.0 109.784 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.81 -47.94 81.16 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.327 -0.858 . . . . 0.0 110.249 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 24.9 tp -54.38 -47.79 72.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.287 -0.883 . . . . 0.0 110.399 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.495 ' CD1' HD12 ' A' ' 85' ' ' ILE . 9.3 mt -78.47 -11.31 59.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.162 -0.961 . . . . 0.0 110.237 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.512 ' O ' ' CG ' ' A' ' 135' ' ' ARG . 6.6 ttm180 -106.19 41.78 1.36 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.231 -0.918 . . . . 0.0 110.222 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.97 -44.89 5.35 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.261 -0.9 . . . . 0.0 110.38 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 50.64 -166.77 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.169 -0.957 . . . . 0.0 110.047 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.412 ' N ' ' OD1' ' A' ' 138' ' ' ASP . 32.1 p-10 -152.45 72.26 0.98 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 110.34 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -84.23 -36.18 22.92 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.323 -0.861 . . . . 0.0 110.24 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.439 ' N ' HD21 ' A' ' 140' ' ' LEU . 3.5 mm? -95.6 102.46 14.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.274 -0.891 . . . . 0.0 110.223 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -90.15 42.23 1.09 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.22 -0.925 . . . . 0.0 110.161 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.428 ' O ' ' O ' ' A' ' 143' ' ' GLU . 31.8 tp10 -147.58 -45.65 0.17 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.34 -0.85 . . . . 0.0 110.226 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.428 ' O ' ' O ' ' A' ' 142' ' ' GLU . 0.2 OUTLIER 59.61 115.94 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.241 -0.912 . . . . 0.0 110.221 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.233 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 3.0 m -139.83 112.2 7.74 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.308 -1.113 . . . . 0.0 110.215 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 3.4 p -78.42 113.9 16.84 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.301 -0.874 . . . . 0.0 110.135 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -143.18 -149.51 0.27 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.185 -0.947 . . . . 0.0 110.199 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mmm -81.42 93.48 6.62 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.141 -0.974 . . . . 0.0 110.103 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.9 t -132.06 111.36 11.43 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.213 -0.929 . . . . 0.0 110.203 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.24 -168.14 2.47 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -0.875 . . . . 0.0 110.146 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -130.14 -179.13 5.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.236 -0.915 . . . . 0.0 110.27 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.5 m -131.25 -48.54 1.0 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.25 -0.906 . . . . 0.0 110.133 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.56 169.67 8.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.889 . . . . 0.0 110.239 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -107.97 6.33 27.06 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 110.123 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -115.95 157.84 23.95 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.273 -0.892 . . . . 0.0 110.196 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -58.01 158.31 6.89 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 110.169 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.7 mtt -104.94 -157.88 0.63 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.312 -0.867 . . . . 0.0 110.188 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -78.21 -168.62 1.36 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.244 -0.91 . . . . 0.0 110.151 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.465 ' OD1' ' CD2' ' A' ' 15' ' ' HIS . 1.5 t-20 -136.93 109.28 7.33 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.248 -0.907 . . . . 0.0 110.216 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.434 ' O ' ' C ' ' A' ' 14' ' ' VAL . 2.4 mp -95.41 154.46 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.264 -0.898 . . . . 0.0 110.284 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.434 ' C ' ' O ' ' A' ' 13' ' ' ILE . 5.0 t 41.04 89.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.474 -0.766 . . . . 0.0 110.294 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.465 ' CD2' ' OD1' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -82.93 -158.12 0.26 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.189 -0.945 . . . . 0.0 110.257 -179.914 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -137.89 -84.33 0.31 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.292 -0.88 . . . . 0.0 110.127 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.462 ' C ' ' CD1' ' A' ' 17' ' ' TYR . 14.9 p90 -70.22 165.99 20.98 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 0.0 110.099 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -156.14 23.68 0.37 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.194 -0.941 . . . . 0.0 110.125 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 18' ' ' SER . 5.6 mt-10 57.07 52.69 8.78 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.331 -0.856 . . . . 0.0 110.163 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.494 ' HB2' ' CG1' ' A' ' 56' ' ' ILE . . . -53.31 -49.0 67.94 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.275 -0.891 . . . . 0.0 110.117 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.44 ' CG ' ' N ' ' A' ' 22' ' ' ILE . 14.4 pt-20 -44.06 -37.58 3.1 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.992 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.44 ' N ' ' CG ' ' A' ' 21' ' ' GLU . 29.3 mm -72.07 -42.63 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.322 -0.861 . . . . 0.0 110.074 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.501 ' O ' ' CD1' ' A' ' 39' ' ' LEU . 29.0 mmtt -56.41 -32.75 65.14 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.178 -0.951 . . . . 0.0 110.226 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.52 ' CG2' HG21 ' A' ' 56' ' ' ILE . 90.1 t -76.75 -37.46 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.294 -0.879 . . . . 0.0 110.191 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.3 -37.89 75.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.171 -0.956 . . . . 0.0 110.24 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -82.83 -48.85 10.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.328 -0.857 . . . . 0.0 110.164 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.519 ' HB3' ' CD1' ' A' ' 39' ' ' LEU . . . -44.6 -47.78 10.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.9 . . . . 0.0 110.17 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 76' ' ' LYS . 4.8 p -68.57 -54.7 14.96 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.346 -0.846 . . . . 0.0 110.183 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.91 -171.79 2.42 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.304 -0.872 . . . . 0.0 110.271 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -126.86 136.39 52.27 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.277 -0.889 . . . . 0.0 110.207 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -131.77 149.15 72.62 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.206 -0.934 . . . . 0.0 110.274 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -65.64 -177.53 0.74 Allowed 'Trans proline' 0 C--N 1.305 -1.712 0 O-C-N 124.04 1.547 . . . . 0.0 110.406 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER 60.5 -152.9 0.38 Allowed 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.213 -0.93 . . . . 0.0 110.465 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.23 67.68 1.12 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -66.22 -35.7 31.45 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.963 1.507 . . . . 0.0 110.425 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.61 -178.01 3.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.181 -0.949 . . . . 0.0 110.259 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.6 t -119.77 123.71 44.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.257 -0.902 . . . . 0.0 110.255 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.2 49.84 0.4 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.231 -0.918 . . . . 0.0 110.058 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.519 ' CD1' ' HB3' ' A' ' 27' ' ' ALA . 0.5 OUTLIER -121.12 -20.77 6.67 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.281 -0.887 . . . . 0.0 110.229 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -90.28 -59.38 2.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.281 -0.887 . . . . 0.0 110.203 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.07 -12.44 61.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.301 -0.874 . . . . 0.0 110.228 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -83.98 -66.01 0.94 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.292 -0.88 . . . . 0.0 110.336 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.519 ' CD1' HD13 ' A' ' 80' ' ' LEU . 79.8 mt -46.24 -38.1 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.217 -0.927 . . . . 0.0 110.094 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.561 ' HB1' HD22 ' A' ' 84' ' ' LEU . . . -68.11 -52.01 39.83 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.184 -0.948 . . . . 0.0 109.387 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.491 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 19.7 t0 -53.61 -20.84 5.68 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.064 -1.022 . . . . 0.0 108.912 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.486 ' CD1' ' HA ' ' A' ' 20' ' ' ALA . 13.4 mt -81.56 -36.41 29.11 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.578 -0.702 . . . . 0.0 110.06 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.526 HG23 HG21 ' A' ' 92' ' ' VAL . 73.1 p -52.19 -40.92 62.18 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.08 -1.013 . . . . 0.0 109.157 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.558 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 79.6 m-85 -43.22 -43.87 4.96 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 119.556 -0.857 . . . . 0.0 109.394 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 51' ' ' VAL . 1.2 t-20 -73.72 91.31 1.89 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.62 -0.675 . . . . 0.0 110.45 179.454 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -11.56 -56.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.696 178.183 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.547 HG13 ' N ' ' A' ' 52' ' ' ALA . 2.7 t -63.97 -65.85 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 120.972 -1.08 . . . . 0.0 110.197 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.547 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -39.33 -41.96 0.98 Allowed 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 121.241 0.543 . . . . 0.0 110.633 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.603 ' CE1' ' HA ' ' A' ' 92' ' ' VAL . 4.2 t80 -62.1 -57.57 11.09 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.458 -0.776 . . . . 0.0 110.546 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 58' ' ' SER . 0.4 OUTLIER -55.17 -24.7 28.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.21 -0.931 . . . . 0.0 110.418 -179.458 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -87.87 -25.0 23.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.247 -0.908 . . . . 0.0 110.272 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.52 HG21 ' CG2' ' A' ' 24' ' ' VAL . 19.7 mt -74.75 -70.28 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.369 -0.832 . . . . 0.0 110.426 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.467 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 4.2 mtp -45.82 -37.94 6.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.22 -0.925 . . . . 0.0 110.097 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.414 ' HB2' ' O ' ' A' ' 54' ' ' SER . 0.4 OUTLIER -53.22 -59.02 5.09 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.191 -0.943 . . . . 0.0 109.861 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -27.74 67.83 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.181 -0.949 . . . . 0.0 109.585 179.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.538 HG21 HD12 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -68.82 -29.05 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.425 -0.797 . . . . 0.0 109.705 179.539 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.508 ' CE3' HD11 ' A' ' 64' ' ' LEU . 20.9 m95 -79.08 -37.18 39.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.189 -0.944 . . . . 0.0 110.229 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -62.86 -56.76 14.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.255 -0.903 . . . . 0.0 110.314 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.43 -26.26 68.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.212 -0.93 . . . . 0.0 110.252 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.728 HD21 HD12 ' A' ' 106' ' ' LEU . 8.4 mt -64.51 -15.43 60.85 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.287 -0.883 . . . . 0.0 110.354 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.479 ' O ' ' O ' ' A' ' 66' ' ' ASP . 1.6 m120 -110.89 41.27 1.84 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.249 -0.907 . . . . 0.0 110.354 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.479 ' O ' ' O ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -55.2 -163.0 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.338 -0.851 . . . . 0.0 110.088 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.402 ' O ' ' C ' ' A' ' 68' ' ' GLY . 0.2 OUTLIER -156.97 -170.2 3.21 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.024 -1.048 . . . . 0.0 110.671 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.402 ' C ' ' O ' ' A' ' 67' ' ' HIS . . . 45.19 -141.73 4.06 Favored Glycine 0 N--CA 1.484 1.891 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -99.61 14.92 28.33 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.495 -1.003 . . . . 0.0 109.922 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -89.67 28.37 1.33 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.259 -0.9 . . . . 0.0 110.195 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.507 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 26.0 p-90 -59.92 -15.8 24.6 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 110.067 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.507 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 4.2 tpt180 -43.47 -43.4 5.35 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.27 -0.894 . . . . 0.0 110.097 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 39.3 m170 -56.86 -47.28 80.77 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.246 -0.909 . . . . 0.0 110.063 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.552 HG13 ' CG1' ' A' ' 123' ' ' VAL . 59.4 t -51.87 -49.57 36.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.287 -0.883 . . . . 0.0 109.925 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.523 ' CE1' ' HG2' ' A' ' 126' ' ' LYS . 10.0 t80 -51.41 -59.84 3.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.191 -0.943 . . . . 0.0 109.925 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.411 ' CB ' ' O ' ' A' ' 28' ' ' THR . 8.6 mmtt -52.1 -27.0 12.52 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.905 . . . . 0.0 109.779 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.524 ' HB3' ' CD2' ' A' ' 64' ' ' LEU . . . -68.31 -54.36 17.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.376 -0.827 . . . . 0.0 110.232 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.523 ' HE3' HG12 ' A' ' 123' ' ' VAL . 2.3 mpp? -47.09 -38.13 10.82 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.382 -0.823 . . . . 0.0 110.34 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.6 m -67.18 -38.77 85.95 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.165 -0.959 . . . . 0.0 110.212 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.52 ' CD2' HD12 ' A' ' 60' ' ' ILE . 16.7 tp -65.85 -64.58 0.83 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.224 -0.922 . . . . 0.0 109.138 179.119 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.551 ' HG3' ' CD2' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -51.86 -27.15 11.72 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.268 -0.895 . . . . 0.0 110.331 179.536 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.53 ' CA ' HD23 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -75.84 -35.47 59.96 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.006 -1.059 . . . . 0.0 110.035 179.629 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.56 ' CE2' HG23 ' A' ' 87' ' ' THR . 33.8 t80 -75.81 -58.21 3.42 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.403 -0.811 . . . . 0.0 110.58 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.561 HD22 ' HB1' ' A' ' 44' ' ' ALA . 5.3 mt -46.72 -48.49 20.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.169 -0.957 . . . . 0.0 109.83 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.549 HD12 HD13 ' A' ' 130' ' ' LEU . 63.1 mt -48.23 -43.05 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.107 -0.996 . . . . 0.0 110.322 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.3 tttp -75.55 -78.0 0.12 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.251 -0.906 . . . . 0.0 110.717 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.56 HG23 ' CE2' ' A' ' 83' ' ' TYR . 7.8 t -86.01 -25.61 25.87 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.159 -0.963 . . . . 0.0 110.764 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.558 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -43.48 -80.13 0.05 OUTLIER Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.4 t -172.25 161.6 5.38 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.175 -1.191 . . . . 0.0 110.194 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.4 -27.04 68.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.206 -0.934 . . . . 0.0 110.186 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.442 ' HG3' ' CD2' ' A' ' 53' ' ' PHE . 9.9 ptp180 -72.75 -34.67 67.18 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.197 -0.939 . . . . 0.0 109.852 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.603 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 54.0 t -58.4 -51.63 69.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.284 -0.885 . . . . 0.0 109.942 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.411 ' HA ' HG12 ' A' ' 85' ' ' ILE . 5.3 t -58.46 -41.36 85.02 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.177 -0.952 . . . . 0.0 109.71 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -57.95 -40.07 79.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.226 -0.921 . . . . 0.0 109.795 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.477 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 6.4 tp-100 -67.53 -39.37 85.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.315 -0.866 . . . . 0.0 109.397 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 2.7 t -56.59 -31.95 64.76 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.221 -0.924 . . . . 0.0 108.831 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.443 ' HA ' ' SD ' ' A' ' 100' ' ' MET . 0.8 OUTLIER -81.42 -24.92 36.58 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.512 -0.742 . . . . 0.0 109.771 179.333 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.512 ' HG3' ' N ' ' A' ' 99' ' ' ASN . 0.1 OUTLIER -77.94 -22.84 48.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.245 -0.909 . . . . 0.0 109.743 179.736 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' A' ' 98' ' ' GLU . 8.4 t30 -132.19 38.53 3.48 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.555 -0.716 . . . . 0.0 109.797 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.443 ' SD ' ' HA ' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -60.53 -34.72 74.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.834 . . . . 0.0 109.908 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.446 ' O ' ' HB ' ' A' ' 105' ' ' THR . 66.3 m-85 -57.08 -27.96 62.18 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.301 -0.874 . . . . 0.0 109.688 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.519 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -71.93 -42.86 66.15 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.459 -0.775 . . . . 0.0 110.077 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.463 ' O ' ' HB3' ' A' ' 127' ' ' ALA . 6.2 t -68.81 -28.16 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.446 ' HG2' HG22 ' A' ' 131' ' ' VAL . 1.2 mm100 -90.37 -20.66 22.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.915 . . . . 0.0 110.449 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.519 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 6.2 t -61.32 -22.44 64.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.198 -0.939 . . . . 0.0 110.24 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.728 HD12 HD21 ' A' ' 64' ' ' LEU . 35.3 mt -61.44 -39.12 89.65 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 110.204 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.467 ' HA ' ' HB2' ' A' ' 124' ' ' ARG . 0.2 OUTLIER -44.14 -31.06 0.86 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.209 -0.932 . . . . 0.0 110.146 179.894 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.49 -38.55 14.89 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.265 -0.897 . . . . 0.0 110.259 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -49.14 113.19 0.75 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.259 -0.901 . . . . 0.0 110.284 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.0 147.6 31.83 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.227 -0.921 . . . . 0.0 110.195 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -159.4 127.18 4.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.297 -0.877 . . . . 0.0 110.307 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.47 ' O ' ' O ' ' A' ' 113' ' ' ASP . 52.1 t -128.67 -2.24 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.251 -0.906 . . . . 0.0 110.192 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.47 ' O ' ' O ' ' A' ' 112' ' ' VAL . 1.3 m-20 45.69 -172.74 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.104 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -51.11 -47.75 61.87 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.188 -0.945 . . . . 0.0 110.066 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -130.39 125.36 34.35 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.416 -0.803 . . . . 0.0 110.109 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.455 ' O ' ' OE1' ' A' ' 119' ' ' GLN . . . -174.77 -33.22 0.04 OUTLIER Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.448 ' CB ' ' O ' ' A' ' 116' ' ' GLY . 0.0 OUTLIER 67.39 142.5 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.32 -1.106 . . . . 0.0 110.37 179.871 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -54.03 108.67 0.38 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.266 -0.896 . . . . 0.0 110.172 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.455 ' OE1' ' O ' ' A' ' 116' ' ' GLY . 10.9 pt20 -149.53 16.0 0.89 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.198 -0.939 . . . . 0.0 110.142 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -101.6 34.35 5.75 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.552 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p -80.11 -41.96 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -1.164 . . . . 0.0 110.148 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.552 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 2.6 m-80 -37.72 -28.31 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.816 -0.552 . . . . 0.0 110.804 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.552 ' CG1' HG13 ' A' ' 74' ' ' VAL . 3.8 t -81.72 -58.72 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.188 -0.945 . . . . 0.0 110.382 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -50.62 -30.96 14.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.222 -0.924 . . . . 0.0 110.799 -179.476 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -81.45 -53.76 6.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.221 -0.925 . . . . 0.0 111.169 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.523 ' HG2' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -51.64 -47.12 63.85 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.081 -1.012 . . . . 0.0 110.593 -179.465 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.506 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -67.65 -41.55 83.63 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.3 -0.875 . . . . 0.0 111.003 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 124' ' ' ARG . 0.2 OUTLIER -58.53 -43.84 89.37 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.074 -1.016 . . . . 0.0 110.884 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.452 ' N ' ' OE1' ' A' ' 129' ' ' GLN . 0.5 OUTLIER -64.94 -49.44 70.36 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.086 -1.009 . . . . 0.0 110.803 -179.519 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.551 ' CD2' ' HG3' ' A' ' 81' ' ' MET . 12.1 tp -51.26 -41.69 60.55 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.062 -1.024 . . . . 0.0 110.258 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.446 HG22 ' HG2' ' A' ' 104' ' ' GLN . 25.3 t -66.3 -32.77 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.252 -0.905 . . . . 0.0 109.878 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.9 -51.71 56.32 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.145 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.43 ' O ' ' C ' ' A' ' 134' ' ' LEU . 0.5 OUTLIER -61.69 -42.07 98.43 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.323 -0.86 . . . . 0.0 110.446 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.488 ' CD2' HD11 ' A' ' 85' ' ' ILE . 1.5 mm? -42.46 -64.48 0.6 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.309 -0.87 . . . . 0.0 110.299 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 15.6 ttp85 -114.08 63.67 0.66 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.288 -0.882 . . . . 0.0 110.201 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -76.08 -47.79 23.24 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.262 -0.899 . . . . 0.0 110.24 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -174.98 -171.63 0.54 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.194 -0.941 . . . . 0.0 110.232 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.414 ' N ' ' OD1' ' A' ' 138' ' ' ASP . 3.4 m-20 -105.34 61.16 0.68 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.286 -0.884 . . . . 0.0 110.157 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -101.75 -31.29 10.84 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.18 -0.95 . . . . 0.0 110.262 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -111.58 105.88 14.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.214 -0.929 . . . . 0.0 110.287 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -114.01 -36.59 4.71 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.218 -0.926 . . . . 0.0 110.253 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -156.39 83.89 0.98 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 110.245 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.433 ' O ' ' O ' ' A' ' 144' ' ' ARG . 0.4 OUTLIER -149.56 52.23 0.94 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.196 -0.94 . . . . 0.0 110.16 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.433 ' O ' ' O ' ' A' ' 143' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.095 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.35 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 4.0 p -145.84 19.96 1.46 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.151 -1.205 . . . . 0.0 110.259 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 58.0 177.46 0.06 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.145 -0.972 . . . . 0.0 110.205 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -73.58 169.34 17.46 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.252 -0.905 . . . . 0.0 110.315 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 ptp -148.59 170.9 17.07 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.312 -0.867 . . . . 0.0 110.192 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 t -68.5 120.57 14.76 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.215 -0.928 . . . . 0.0 110.196 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 8.8 t -157.33 46.4 0.39 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.206 -0.934 . . . . 0.0 110.212 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.6 m -160.15 147.34 16.23 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.264 -0.898 . . . . 0.0 110.121 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 71.0 m -89.36 170.59 10.42 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.232 -0.917 . . . . 0.0 110.161 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.06 132.25 46.82 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.325 -0.859 . . . . 0.0 110.203 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.424 ' C ' ' HG2' ' A' ' 8' ' ' ARG . 3.6 mmt-85 -44.54 -90.66 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.27 -0.894 . . . . 0.0 110.158 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.424 ' HG2' ' C ' ' A' ' 7' ' ' ARG . 6.6 mmt180 -130.74 -143.26 0.24 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.118 -0.989 . . . . 0.0 110.153 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.416 ' C ' ' O ' ' A' ' 8' ' ' ARG . 2.8 mm-40 -42.91 148.55 0.24 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.231 -0.918 . . . . 0.0 110.234 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 11.0 ptt? -66.36 -169.65 0.08 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -83.43 -166.41 1.36 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.296 -0.878 . . . . 0.0 110.178 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -103.32 104.9 15.06 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.274 -0.891 . . . . 0.0 110.149 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 15.4 mm -103.52 160.69 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.272 -0.892 . . . . 0.0 110.286 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.6 m -47.77 115.02 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.23 -0.919 . . . . 0.0 110.262 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -83.52 72.15 10.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.219 -0.926 . . . . 0.0 110.225 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -93.02 -172.14 2.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.128 -0.983 . . . . 0.0 110.167 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.456 ' O ' ' CB ' ' A' ' 18' ' ' SER . 3.7 m-85 -78.47 168.47 19.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.216 -0.927 . . . . 0.0 110.175 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.463 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 0.3 OUTLIER 172.3 -66.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.228 -0.92 . . . . 0.0 110.207 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 18' ' ' SER . 59.8 mt-10 57.25 16.55 3.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.238 -0.914 . . . . 0.0 110.385 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.495 ' HB1' HG13 ' A' ' 56' ' ' ILE . . . -58.91 -47.22 85.78 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.297 -0.877 . . . . 0.0 110.182 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.401 ' HG3' HG12 ' A' ' 22' ' ' ILE . 10.4 pt-20 -45.22 -30.95 1.33 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.275 -0.891 . . . . 0.0 109.991 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.401 HG12 ' HG3' ' A' ' 21' ' ' GLU . 27.9 mm -75.5 -44.74 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.345 -0.847 . . . . 0.0 110.038 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.457 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 2.9 mmtp -55.53 -51.88 65.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.244 -0.91 . . . . 0.0 110.003 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.547 HG21 HG23 ' A' ' 56' ' ' ILE . 98.7 t -58.57 -37.63 66.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.224 -0.923 . . . . 0.0 110.064 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -69.05 0.13 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.253 -0.904 . . . . 0.0 109.977 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -64.08 -13.64 48.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.423 -0.798 . . . . 0.0 110.199 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.528 ' HB1' ' CD1' ' A' ' 39' ' ' LEU . . . -77.0 -30.3 55.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.249 -0.907 . . . . 0.0 110.082 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.453 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 32.7 p -99.74 34.23 2.32 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.304 -0.872 . . . . 0.0 110.031 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.8 p -172.11 125.99 0.55 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.254 -0.904 . . . . 0.0 109.945 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -151.9 150.71 30.37 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.161 -0.962 . . . . 0.0 110.453 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.596 ' CB ' ' CD ' ' A' ' 32' ' ' PRO . 0.8 OUTLIER -175.27 -61.54 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.339 -0.851 . . . . 0.0 110.002 179.82 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.596 ' CD ' ' CB ' ' A' ' 31' ' ' ASP . 29.4 Cg_endo -69.12 168.66 20.07 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 O-C-N 123.927 1.488 . . . . 0.0 110.174 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.416 ' O ' ' O ' ' A' ' 32' ' ' PRO . 0.5 OUTLIER 53.07 172.99 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.265 -0.897 . . . . 0.0 110.661 179.816 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.98 -142.65 2.84 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -66.09 -175.36 0.49 Allowed 'Trans proline' 0 C--N 1.306 -1.71 0 O-C-N 124.026 1.54 . . . . 0.0 110.39 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.58 -177.44 3.36 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.263 -0.898 . . . . 0.0 110.229 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.5 m -110.38 -77.22 0.6 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.267 -0.896 . . . . 0.0 110.209 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.3 m -130.71 76.2 1.71 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.238 -0.914 . . . . 0.0 110.247 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.528 ' CD1' ' HB1' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -102.73 -47.92 4.26 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.915 . . . . 0.0 110.247 179.949 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.35 -53.75 9.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.268 -0.895 . . . . 0.0 110.235 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.3 t -56.75 -27.46 59.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.198 -0.939 . . . . 0.0 110.207 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 38' ' ' SER . 0.0 OUTLIER -78.16 -50.19 12.43 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.3 -0.875 . . . . 0.0 110.233 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.519 HG22 ' CD1' ' A' ' 84' ' ' LEU . 82.1 mt -56.31 -36.48 46.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.201 -0.937 . . . . 0.0 110.012 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.546 ' HB2' HD21 ' A' ' 84' ' ' LEU . . . -67.65 -49.85 60.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.303 -0.873 . . . . 0.0 109.654 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.444 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 25.8 t70 -55.31 -18.86 7.12 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.124 -0.985 . . . . 0.0 109.141 179.129 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.473 ' O ' ' HB2' ' A' ' 49' ' ' ASN . 10.7 mt -85.32 -34.22 21.91 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.529 -0.732 . . . . 0.0 110.119 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.482 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 76.1 p -56.23 -41.08 75.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.153 -0.967 . . . . 0.0 109.521 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.582 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 85.4 m-85 -43.3 -43.69 5.06 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 119.776 -0.77 . . . . 0.0 109.195 179.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 46' ' ' LEU . 5.6 m-20 -58.87 -160.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.662 0.744 . . . . 0.0 110.051 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.424 HG21 ' N ' ' A' ' 51' ' ' VAL . 3.0 m -122.01 -32.35 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -178.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 52' ' ' ALA . 10.6 t -85.64 -70.86 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 CA-C-O 121.947 0.88 . . . . 0.0 109.806 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.56 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -38.31 -40.38 0.52 Allowed 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.787 -177.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.482 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 7.4 t80 -55.39 -58.86 6.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.257 -0.902 . . . . 0.0 110.291 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 58' ' ' SER . 67.3 m -55.62 -41.08 72.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.18 -0.95 . . . . 0.0 110.086 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.6 -25.08 67.24 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.359 -0.838 . . . . 0.0 109.971 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.547 HG23 HG21 ' A' ' 24' ' ' VAL . 10.8 mt -79.33 -70.4 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.404 -0.81 . . . . 0.0 110.144 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 15.3 mtp -47.96 -39.82 20.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.192 -0.943 . . . . 0.0 109.596 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.419 ' HB2' ' O ' ' A' ' 54' ' ' SER . 38.5 t -53.42 -57.29 11.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.325 -0.86 . . . . 0.0 109.762 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.421 ' HB3' HG11 ' A' ' 24' ' ' VAL . 8.8 mmt -62.17 -23.17 66.44 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.232 -0.918 . . . . 0.0 109.596 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.556 HG21 HD13 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -72.42 -31.74 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.405 -0.81 . . . . 0.0 109.29 179.524 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -74.7 -44.99 47.29 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.352 -0.842 . . . . 0.0 109.722 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.59 -52.93 61.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.254 -0.904 . . . . 0.0 109.705 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.497 ' HD3' ' CD2' ' A' ' 73' ' ' HIS . 14.5 mmp_? -62.7 -35.79 80.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.229 -0.92 . . . . 0.0 109.713 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.609 HD21 ' CD1' ' A' ' 106' ' ' LEU . 4.1 mt -54.4 -24.02 18.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.351 -0.843 . . . . 0.0 110.052 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -122.02 48.82 1.65 Allowed 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.469 -0.769 . . . . 0.0 109.141 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.473 ' HB2' ' HB3' ' A' ' 73' ' ' HIS . 0.7 OUTLIER -82.71 165.34 20.03 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.475 -0.766 . . . . 0.0 110.855 -178.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.462 ' O ' ' O ' ' A' ' 66' ' ' ASP . 22.2 m170 54.13 165.18 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.691 -0.631 . . . . 0.0 110.362 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.574 ' O ' ' CE1' ' A' ' 109' ' ' PHE . . . -58.47 -95.83 0.01 OUTLIER Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.524 ' O ' ' CG ' ' A' ' 69' ' ' LYS . 27.3 ttmt -104.71 20.85 17.92 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.708 -0.878 . . . . 0.0 110.457 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.543 ' HA ' ' HB2' ' A' ' 111' ' ' TYR . 1.4 t-20 -76.8 146.97 37.5 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.491 -0.755 . . . . 0.0 110.741 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.566 ' CD1' ' HA2' ' A' ' 120' ' ' GLY . 58.4 p-90 -110.55 18.2 19.98 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.424 -0.798 . . . . 0.0 110.468 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.0 mmt180 -71.44 -70.35 0.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.188 -0.945 . . . . 0.0 110.492 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.497 ' CD2' ' HD3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -55.98 -49.46 73.52 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.214 -0.929 . . . . 0.0 110.138 -179.851 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.537 HG12 ' CG1' ' A' ' 123' ' ' VAL . 68.8 t -44.0 -53.01 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.434 -0.791 . . . . 0.0 110.488 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.493 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 5.3 t80 -49.68 -56.27 10.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.273 -0.892 . . . . 0.0 110.196 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.453 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -56.59 -28.53 60.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.201 -0.937 . . . . 0.0 110.144 179.945 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.55 ' HB3' ' CD2' ' A' ' 64' ' ' LEU . . . -71.14 -34.92 71.48 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.361 -0.837 . . . . 0.0 109.81 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.531 ' HE2' ' CG1' ' A' ' 74' ' ' VAL . 0.6 OUTLIER -61.8 -38.9 89.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.472 -0.768 . . . . 0.0 109.715 179.52 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 40.9 m -61.04 -63.91 1.13 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.278 -0.889 . . . . 0.0 110.058 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.539 ' CD2' HD12 ' A' ' 60' ' ' ILE . 20.1 tp -47.35 -54.1 12.03 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.212 -0.93 . . . . 0.0 110.068 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.521 ' HG2' ' CD2' ' A' ' 130' ' ' LEU . 3.7 ttp -50.76 -37.25 40.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.193 -0.942 . . . . 0.0 110.365 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.475 ' HA ' HD13 ' A' ' 85' ' ' ILE . 26.2 tt0 -74.17 -68.58 0.51 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.096 -1.003 . . . . 0.0 110.574 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.561 ' CE2' HG23 ' A' ' 87' ' ' THR . 55.0 t80 -37.58 -45.91 0.8 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.494 -0.754 . . . . 0.0 111.367 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.546 HD21 ' HB2' ' A' ' 44' ' ' ALA . 75.6 mt -66.68 -42.31 86.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.14 -0.975 . . . . 0.0 110.695 -179.243 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.526 ' N ' HG13 ' A' ' 92' ' ' VAL . 32.3 mt -52.73 -19.91 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 120.933 -1.104 . . . . 0.0 110.158 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.82 -87.96 0.44 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.297 -0.877 . . . . 0.0 110.293 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.561 HG23 ' CE2' ' A' ' 83' ' ' TYR . 14.9 t -69.41 -6.21 28.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.224 -0.922 . . . . 0.0 110.222 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.582 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -72.19 -78.74 0.48 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.3 t -174.81 157.01 2.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.11 -1.229 . . . . 0.0 110.234 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.92 -21.84 65.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.302 -0.874 . . . . 0.0 110.191 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.28 -39.5 59.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.22 -0.925 . . . . 0.0 110.08 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.526 HG13 ' N ' ' A' ' 85' ' ' ILE . 78.4 t -58.69 -31.48 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.289 -0.882 . . . . 0.0 110.074 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 29.6 p -79.06 -38.69 35.79 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.159 -0.963 . . . . 0.0 110.018 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -59.67 -59.37 5.55 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.283 -0.885 . . . . 0.0 109.832 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.42 -35.85 63.37 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.481 -0.762 . . . . 0.0 109.8 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.467 ' SG ' HD11 ' A' ' 85' ' ' ILE . 11.6 m -60.91 -36.38 79.12 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.19 -0.944 . . . . 0.0 109.713 179.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.46 ' HG3' ' HG2' ' A' ' 135' ' ' ARG . 29.9 ttpt -73.83 -26.63 60.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.403 -0.811 . . . . 0.0 109.589 179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -81.85 -22.84 36.76 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.373 -0.829 . . . . 0.0 110.057 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -111.52 34.75 3.95 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.286 -0.884 . . . . 0.0 110.34 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.535 ' HE3' ' CZ ' ' A' ' 101' ' ' TYR . 5.6 ptp -60.97 -31.06 70.65 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.215 -0.928 . . . . 0.0 110.17 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.535 ' CZ ' ' HE3' ' A' ' 100' ' ' MET . 32.1 m-85 -61.42 -26.27 67.75 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.888 . . . . 0.0 110.2 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.521 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -76.65 -40.75 48.15 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.244 -0.91 . . . . 0.0 110.15 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.509 ' HB ' ' CG2' ' A' ' 131' ' ' VAL . 5.3 t -72.12 -27.46 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.376 -0.828 . . . . 0.0 110.151 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.471 ' HG2' HG23 ' A' ' 131' ' ' VAL . 15.5 mm-40 -82.18 -26.89 32.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.174 -0.954 . . . . 0.0 110.315 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.521 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 7.1 t -64.85 -12.64 50.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.128 -0.983 . . . . 0.0 110.04 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.609 ' CD1' HD21 ' A' ' 64' ' ' LEU . 65.4 mt -77.23 -33.17 56.18 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.274 -0.891 . . . . 0.0 110.181 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.525 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 1.2 ttmt -41.41 -27.47 0.09 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.378 -0.827 . . . . 0.0 110.464 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.435 ' N ' ' O ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -90.03 -37.91 13.97 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.257 -0.902 . . . . 0.0 110.276 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.574 ' CE1' ' O ' ' A' ' 68' ' ' GLY . 0.1 OUTLIER -41.62 100.88 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.3 -0.875 . . . . 0.0 110.58 -179.847 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.457 ' CG ' ' O ' ' A' ' 110' ' ' GLN . 6.0 pt20 -153.0 84.16 1.21 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.329 -0.857 . . . . 0.0 110.353 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.543 ' HB2' ' HA ' ' A' ' 70' ' ' ASN . 0.5 OUTLIER -77.33 124.54 28.0 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.2 -0.937 . . . . 0.0 109.85 179.814 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.544 ' CG2' ' N ' ' A' ' 117' ' ' LYS . 3.4 p -113.23 -11.7 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.118 -0.988 . . . . 0.0 110.589 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.529 ' CB ' ' OD1' ' A' ' 115' ' ' ASP . 1.2 m-20 55.58 -178.37 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.371 -0.831 . . . . 0.0 110.572 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.512 ' HD2' ' N ' ' A' ' 115' ' ' ASP . 5.0 ppt_? -55.42 -45.19 76.76 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.32 -0.863 . . . . 0.0 110.913 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.529 ' OD1' ' CB ' ' A' ' 113' ' ' ASP . 5.2 p-10 -38.99 -28.24 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.401 -0.812 . . . . 0.0 110.741 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 114' ' ' ARG . . . 63.09 39.6 98.2 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.544 ' N ' ' CG2' ' A' ' 112' ' ' VAL . 2.2 mmtt -107.07 97.58 7.34 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.324 -1.103 . . . . 0.0 110.177 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -56.2 114.02 1.8 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.202 -0.936 . . . . 0.0 110.167 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -152.64 27.23 0.56 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.256 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.566 ' HA2' ' CD1' ' A' ' 71' ' ' TRP . . . -111.71 62.82 0.29 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.542 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 2.8 p -113.14 -41.47 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 O-C-N 121.245 -1.15 . . . . 0.0 110.146 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.542 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.0 OUTLIER -36.13 -31.2 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.833 -0.542 . . . . 0.0 110.775 -179.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.537 ' CG1' HG12 ' A' ' 74' ' ' VAL . 1.0 OUTLIER -82.19 -46.07 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.263 -0.898 . . . . 0.0 109.917 179.783 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.525 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -57.35 -30.88 65.2 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.203 -0.936 . . . . 0.0 110.61 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.451 ' OE1' HG11 ' A' ' 121' ' ' VAL . 44.8 mt-10 -82.71 -54.75 4.89 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.196 -0.94 . . . . 0.0 111.055 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.493 ' HG3' ' CE1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -52.62 -49.64 64.71 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.096 -1.002 . . . . 0.0 110.235 -179.631 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.504 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -61.14 -41.62 97.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.314 -0.866 . . . . 0.0 110.431 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 124' ' ' ARG . 2.4 ttmt -56.9 -49.66 74.91 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.161 -0.962 . . . . 0.0 110.369 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -55.2 -49.59 71.54 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 110.379 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.526 ' O ' ' CD1' ' A' ' 134' ' ' LEU . 0.3 OUTLIER -53.29 -40.82 65.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.161 -0.962 . . . . 0.0 110.161 -179.916 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.509 ' CG2' ' HB ' ' A' ' 103' ' ' VAL . 26.4 t -72.75 -25.91 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.356 -0.84 . . . . 0.0 110.191 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.45 ' O ' ' OD1' ' A' ' 136' ' ' ASP . . . -70.23 -56.17 7.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.218 -0.926 . . . . 0.0 110.389 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 15.7 tp -69.9 -37.8 76.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.289 -0.882 . . . . 0.0 110.377 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.526 ' CD1' ' O ' ' A' ' 130' ' ' LEU . 30.9 mt -70.83 -68.07 0.46 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.154 -0.966 . . . . 0.0 110.206 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.46 ' HG2' ' HG3' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -92.84 113.17 25.38 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.15 -0.969 . . . . 0.0 110.187 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.45 ' OD1' ' O ' ' A' ' 132' ' ' ALA . 0.4 OUTLIER -144.16 -66.44 0.35 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.243 -0.911 . . . . 0.0 110.352 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -167.6 64.8 0.08 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 110.281 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.87 118.98 4.4 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.25 -0.906 . . . . 0.0 110.376 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -96.17 -158.48 0.66 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 110.175 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.441 ' O ' ' O ' ' A' ' 141' ' ' ARG . 0.9 OUTLIER -169.87 151.99 4.32 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.242 -0.912 . . . . 0.0 110.272 179.855 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.441 ' O ' ' O ' ' A' ' 140' ' ' LEU . 0.5 OUTLIER -56.36 -162.44 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.206 -0.934 . . . . 0.0 110.339 -179.846 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 141' ' ' ARG . 2.3 tm-20 63.81 19.25 11.64 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 110.17 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -159.39 -168.65 2.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.304 -0.873 . . . . 0.0 110.25 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.219 179.949 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 1.9 m -99.71 171.89 7.62 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -1.131 . . . . 0.0 110.303 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.84 88.36 2.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.289 -0.882 . . . . 0.0 110.177 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -85.94 173.57 9.86 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.229 -0.92 . . . . 0.0 110.246 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.413 ' O ' ' HB2' ' A' ' 2' ' ' SER . 0.0 OUTLIER -127.47 134.74 49.81 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.248 -0.908 . . . . 0.0 110.131 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.413 ' HB2' ' O ' ' A' ' 1' ' ' MET . 3.6 m 60.45 59.27 2.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.307 -0.871 . . . . 0.0 110.255 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.452 ' O ' ' OG ' ' A' ' 4' ' ' SER . 1.7 m -110.67 144.31 39.8 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.884 . . . . 0.0 110.275 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.452 ' OG ' ' O ' ' A' ' 3' ' ' THR . 94.7 p 44.15 51.38 7.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.284 -0.885 . . . . 0.0 110.168 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.455 ' O ' ' O ' ' A' ' 6' ' ' LEU . 9.4 t -73.15 -45.14 58.4 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -0.931 . . . . 0.0 110.139 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' A' ' 5' ' ' SER . 0.2 OUTLIER 51.76 102.78 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.31 -0.869 . . . . 0.0 110.313 179.968 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -85.84 -165.4 1.23 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.328 -0.857 . . . . 0.0 110.193 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -99.24 153.35 19.01 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.186 -0.946 . . . . 0.0 110.096 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 98.4 mm-40 -90.75 148.89 22.27 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.244 -0.91 . . . . 0.0 110.253 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 99.3 mmm -126.12 -74.29 0.6 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.295 -0.878 . . . . 0.0 110.179 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.0 pttt -47.6 -48.77 28.1 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.24 -0.913 . . . . 0.0 110.499 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 59.4 106.68 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 110.073 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.0 mp -92.32 137.56 21.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.294 -0.879 . . . . 0.0 110.376 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.5 t -104.83 65.16 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.316 -0.865 . . . . 0.0 110.179 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -98.21 -166.24 1.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.251 -0.906 . . . . 0.0 110.306 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.45 ' HB3' ' CB ' ' A' ' 19' ' ' GLU . 25.5 m-20 -83.14 115.98 22.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.244 -0.91 . . . . 0.0 110.222 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -87.65 159.77 18.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.282 -0.886 . . . . 0.0 110.175 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 70.5 m 45.78 27.14 0.43 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -0.93 . . . . 0.0 110.072 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.45 ' CB ' ' HB3' ' A' ' 16' ' ' ASN . 3.4 mt-10 -110.76 -25.11 10.08 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.21 -0.931 . . . . 0.0 110.182 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.463 ' CB ' HD23 ' A' ' 46' ' ' LEU . . . -65.01 -52.97 53.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.233 -0.917 . . . . 0.0 110.15 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.409 ' CG ' ' N ' ' A' ' 22' ' ' ILE . 12.5 pt-20 -50.1 -34.1 20.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.236 -0.915 . . . . 0.0 110.053 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.409 ' N ' ' CG ' ' A' ' 21' ' ' GLU . 13.4 mt -66.07 -39.41 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.255 -0.903 . . . . 0.0 109.934 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.437 ' CB ' HG12 ' A' ' 43' ' ' ILE . 1.6 mmtm -67.11 -39.55 86.69 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.296 -0.877 . . . . 0.0 110.017 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.528 HG21 HG23 ' A' ' 56' ' ' ILE . 56.1 t -57.83 -38.68 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.353 -0.842 . . . . 0.0 110.091 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.472 ' HD3' ' CZ ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -63.35 -50.68 69.01 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.281 -0.887 . . . . 0.0 110.157 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 49.1 tt0 -68.95 -17.05 63.89 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.432 -0.793 . . . . 0.0 109.959 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.488 ' CB ' ' CD2' ' A' ' 39' ' ' LEU . . . -79.78 -33.16 40.79 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.343 -0.848 . . . . 0.0 110.147 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.457 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 82.3 p -93.32 34.55 1.14 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.211 -0.93 . . . . 0.0 110.107 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.441 ' HB2' ' O ' ' A' ' 28' ' ' THR . 2.6 t -177.95 55.17 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.361 -0.837 . . . . 0.0 110.129 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -114.23 77.25 1.04 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.292 -0.88 . . . . 0.0 110.275 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.557 ' N ' ' CD ' ' A' ' 32' ' ' PRO . 0.1 OUTLIER -77.43 -48.23 2.4 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.279 -0.888 . . . . 0.0 110.186 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.557 ' CD ' ' N ' ' A' ' 31' ' ' ASP . 22.4 Cg_exo -60.08 176.5 0.73 Allowed 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 123.978 1.514 . . . . 0.0 110.382 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER 63.58 171.78 0.16 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.193 -0.942 . . . . 0.0 110.563 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.76 179.16 1.5 Allowed Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.42 -73.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.773 0 O-C-N 124.016 1.535 . . . . 0.0 110.178 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.7 t -66.72 154.07 41.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.26 -0.9 . . . . 0.0 110.105 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.38 157.76 44.76 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.156 -0.965 . . . . 0.0 110.197 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.2 t -87.09 41.04 0.95 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.233 -0.917 . . . . 0.0 110.193 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.488 ' CD2' ' CB ' ' A' ' 27' ' ' ALA . 0.8 OUTLIER -114.79 -23.36 9.21 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.301 -0.874 . . . . 0.0 110.22 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 5.4 mtt -67.48 -62.2 1.53 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.171 -0.955 . . . . 0.0 110.234 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.44 -24.2 7.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.263 -0.898 . . . . 0.0 110.267 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.83 -54.02 8.06 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.156 -0.965 . . . . 0.0 110.176 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.472 ' O ' ' HB2' ' A' ' 46' ' ' LEU . 79.3 mt -52.96 -32.85 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.149 -0.969 . . . . 0.0 109.951 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.55 ' HB3' HD21 ' A' ' 84' ' ' LEU . . . -70.23 -52.91 19.54 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.182 -0.949 . . . . 0.0 109.62 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.568 ' HA ' ' CD1' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -51.55 -21.46 2.52 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.021 -1.049 . . . . 0.0 109.455 179.268 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 43' ' ' ILE . 4.6 mt -76.92 -40.97 45.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.429 -0.794 . . . . 0.0 110.133 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.521 HG23 ' CD1' ' A' ' 56' ' ' ILE . 42.9 p -53.97 -43.07 69.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.257 -0.902 . . . . 0.0 109.712 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.568 ' CD1' ' HA ' ' A' ' 45' ' ' ASP . 81.6 m-85 -40.48 -38.96 0.92 Allowed 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 119.945 -0.702 . . . . 0.0 109.529 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.466 ' O ' ' O ' ' A' ' 48' ' ' TYR . 13.7 m120 -58.08 -152.71 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.69 0.757 . . . . 0.0 110.168 179.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.7 t -128.11 -15.89 2.68 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.275 -177.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.646 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 0.3 OUTLIER -110.14 -48.1 6.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 CA-C-O 122.42 1.105 . . . . 0.0 108.569 179.151 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.646 ' N ' ' CG1' ' A' ' 51' ' ' VAL . . . -48.82 -47.27 42.54 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.37 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.509 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 2.1 t80 -56.88 -54.7 43.48 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.374 -0.829 . . . . 0.0 109.819 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.88 -21.62 61.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.276 -0.89 . . . . 0.0 110.325 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' A' ' 51' ' ' VAL . 2.8 mm-40 -90.72 -19.6 23.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.309 -0.87 . . . . 0.0 110.048 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.528 HG23 HG21 ' A' ' 24' ' ' VAL . 7.3 mt -80.77 -70.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.383 -0.823 . . . . 0.0 110.0 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.574 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 95.8 mmm -45.17 -35.57 3.31 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -56.9 -59.56 4.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.345 -0.847 . . . . 0.0 109.806 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.459 ' HB3' HG11 ' A' ' 24' ' ' VAL . 0.0 OUTLIER -59.08 -25.64 63.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.333 -0.854 . . . . 0.0 109.966 179.653 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.537 HG21 HD11 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -74.15 -29.97 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.364 -0.835 . . . . 0.0 109.936 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.574 ' CD1' ' O ' ' A' ' 57' ' ' MET . 18.2 m95 -76.07 -44.76 37.43 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.158 -0.964 . . . . 0.0 110.387 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -49.06 79.11 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.222 -0.924 . . . . 0.0 110.434 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.472 ' CZ ' ' HD3' ' A' ' 25' ' ' ARG . 12.5 mmt85 -70.6 -32.02 69.23 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.22 -0.925 . . . . 0.0 110.32 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.561 HD22 ' CD1' ' A' ' 106' ' ' LEU . 3.9 mt -57.0 -18.67 14.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.319 -0.863 . . . . 0.0 110.503 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.446 ' O ' ' O ' ' A' ' 66' ' ' ASP . 19.0 t30 -104.53 37.93 2.01 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.238 -0.914 . . . . 0.0 109.935 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.463 ' OD2' ' O ' ' A' ' 70' ' ' ASN . 1.0 OUTLIER -54.85 -165.99 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.362 -0.836 . . . . 0.0 110.181 -179.845 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.74 178.64 6.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.352 -0.842 . . . . 0.0 110.217 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -73.6 -54.09 6.93 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.626 -1.389 . . . . 0.0 109.626 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -64.04 -39.14 93.44 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.247 -1.149 . . . . 0.0 110.369 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.463 ' O ' ' OD2' ' A' ' 66' ' ' ASP . 2.4 m120 -92.33 43.01 1.12 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.263 -0.898 . . . . 0.0 110.361 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 47.4 p-90 -65.97 -9.07 26.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.237 -0.914 . . . . 0.0 110.324 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.429 ' HG3' ' N ' ' A' ' 73' ' ' HIS . 1.3 ptp180 -55.56 -27.11 47.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.255 -0.903 . . . . 0.0 110.224 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.429 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -72.71 -36.14 67.74 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 109.986 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.534 HG11 ' CG1' ' A' ' 123' ' ' VAL . 55.6 t -62.62 -59.16 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.318 -0.864 . . . . 0.0 110.024 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.639 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 15.8 t80 -46.78 -43.57 18.36 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.253 -0.904 . . . . 0.0 110.055 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.457 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 7.5 mmtp -65.18 -37.11 86.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.256 -0.902 . . . . 0.0 110.166 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.552 ' HB1' HD21 ' A' ' 64' ' ' LEU . . . -65.9 -27.24 68.05 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.224 -0.922 . . . . 0.0 110.015 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.537 ' CE ' HG13 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -71.4 -39.39 71.17 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.363 -0.836 . . . . 0.0 110.396 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 39.1 m -63.68 -35.81 81.77 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.168 -0.958 . . . . 0.0 110.129 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.525 ' CD2' HD13 ' A' ' 60' ' ' ILE . 33.3 tp -75.98 -37.38 58.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.145 -0.972 . . . . 0.0 109.614 179.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.465 ' O ' HG13 ' A' ' 85' ' ' ILE . 3.4 ttp -72.7 -20.85 61.15 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.269 -0.894 . . . . 0.0 109.97 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.543 ' CA ' HD13 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -89.79 -36.29 15.22 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.266 -0.896 . . . . 0.0 110.244 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.633 ' CE1' ' CG2' ' A' ' 87' ' ' THR . 22.6 t80 -73.25 -42.25 62.76 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.363 -0.835 . . . . 0.0 110.698 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.55 HD21 ' HB3' ' A' ' 44' ' ' ALA . 57.4 mt -67.4 -30.12 69.79 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.255 -0.903 . . . . 0.0 110.365 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.564 ' N ' HG13 ' A' ' 92' ' ' VAL . 17.7 mt -68.66 -13.11 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.084 -1.01 . . . . 0.0 110.039 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.67 -66.96 0.91 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 109.971 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.633 ' CG2' ' CE1' ' A' ' 83' ' ' TYR . 11.5 t -97.13 8.11 45.21 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.341 -0.849 . . . . 0.0 109.94 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.543 ' O ' ' CG2' ' A' ' 92' ' ' VAL . . . -95.93 30.81 7.97 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.516 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.8 OUTLIER 72.29 156.98 0.17 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.305 -1.115 . . . . 0.0 110.288 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.43 -9.96 52.01 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.275 -0.89 . . . . 0.0 110.507 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.4 ' O ' ' HB2' ' A' ' 94' ' ' GLN . 2.2 mmt180 -69.59 -45.53 68.39 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.305 -0.872 . . . . 0.0 109.638 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.564 HG13 ' N ' ' A' ' 85' ' ' ILE . 99.3 t -52.76 -40.53 35.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 121.503 -0.748 . . . . 0.0 109.768 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.8 m -68.48 -39.32 81.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.296 -0.878 . . . . 0.0 109.506 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 91' ' ' ARG . 8.7 mt-30 -55.85 -35.5 66.5 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.331 -0.856 . . . . 0.0 109.397 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.478 ' HA ' ' HG2' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -70.08 -40.2 75.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.451 -0.78 . . . . 0.0 109.014 178.956 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 21.7 t -55.3 -31.95 62.05 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.239 -0.913 . . . . 0.0 108.959 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.9 mttt -82.14 -25.87 34.0 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.567 -0.708 . . . . 0.0 109.924 179.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.509 ' HG3' ' N ' ' A' ' 99' ' ' ASN . 0.0 OUTLIER -75.36 -21.98 57.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 109.856 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.509 ' N ' ' HG3' ' A' ' 98' ' ' GLU . 22.6 t-20 -140.77 44.79 1.82 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.407 -0.808 . . . . 0.0 109.977 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.497 ' HE3' ' NH1' ' A' ' 135' ' ' ARG . 28.5 ttp -59.92 -36.07 76.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.908 . . . . 0.0 110.025 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.439 ' N ' ' CD1' ' A' ' 101' ' ' TYR . 8.7 m-30 -57.62 -27.04 62.42 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.389 -0.819 . . . . 0.0 109.972 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.525 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -69.06 -41.5 77.51 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.385 -0.822 . . . . 0.0 110.085 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.445 HG13 HG23 ' A' ' 131' ' ' VAL . 3.4 t -73.88 -29.7 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.373 -0.83 . . . . 0.0 109.84 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.462 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 7.5 mt-30 -83.45 -20.18 34.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.417 -0.802 . . . . 0.0 110.219 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.525 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 6.5 t -72.34 -20.0 61.55 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.255 -0.903 . . . . 0.0 110.19 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.561 ' CD1' HD22 ' A' ' 64' ' ' LEU . 12.2 mt -64.3 -39.75 94.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.267 -0.896 . . . . 0.0 109.937 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -52.56 -25.47 10.59 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.271 -0.893 . . . . 0.0 110.143 179.885 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.455 ' N ' ' HG3' ' A' ' 107' ' ' LYS . 0.8 OUTLIER -84.27 -35.88 23.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 179.795 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.409 ' C ' ' O ' ' A' ' 108' ' ' ASP . 0.5 OUTLIER -43.08 102.41 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.354 -0.841 . . . . 0.0 110.217 179.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 108' ' ' ASP . 12.6 pt20 -145.76 154.98 42.64 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.23 -0.919 . . . . 0.0 110.206 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -162.91 101.69 1.0 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.294 -0.879 . . . . 0.0 110.168 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 2.0 p -144.17 19.19 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.341 -0.85 . . . . 0.0 110.283 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -54.74 -55.94 24.52 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.237 -0.914 . . . . 0.0 110.198 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.502 ' HG3' ' N ' ' A' ' 115' ' ' ASP . 0.1 OUTLIER -96.96 -45.74 6.48 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.252 -0.905 . . . . 0.0 110.325 -179.951 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.502 ' N ' ' HG3' ' A' ' 114' ' ' ARG . 0.1 OUTLIER -49.06 -61.25 2.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.382 -0.824 . . . . 0.0 110.202 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 94.55 -16.89 60.17 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.8 mttm -88.32 109.93 20.36 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.254 -1.145 . . . . 0.0 110.25 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -84.82 64.27 8.5 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.258 -0.901 . . . . 0.0 110.201 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.28 21.96 10.27 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.176 -0.953 . . . . 0.0 110.156 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -95.84 18.84 56.67 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.456 -1.458 . . . . 0.0 109.456 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.564 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.6 p -83.8 -43.55 17.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.263 -1.14 . . . . 0.0 110.223 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.564 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.7 OUTLIER -39.37 -44.01 1.27 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.59 -0.694 . . . . 0.0 110.61 -179.843 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.537 HG13 ' CE ' ' A' ' 78' ' ' MET . 1.4 t -78.86 -48.67 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.339 -0.85 . . . . 0.0 110.202 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.471 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -44.04 -51.05 8.14 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.272 -0.893 . . . . 0.0 111.201 -179.365 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.457 ' OE2' ' HA ' ' A' ' 122' ' ' ASN . 14.2 pt-20 -72.72 -34.26 66.99 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.273 -0.892 . . . . 0.0 111.186 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.639 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -59.04 -54.6 45.29 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.972 -1.08 . . . . 0.0 110.289 -179.776 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.486 ' CB ' ' SD ' ' A' ' 78' ' ' MET . . . -59.83 -42.94 94.66 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.338 -0.851 . . . . 0.0 110.488 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -60.5 -34.62 74.34 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.236 -0.915 . . . . 0.0 110.477 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 132' ' ' ALA . 1.9 mt-30 -65.48 -42.87 91.72 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.298 -0.876 . . . . 0.0 110.48 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.543 HD13 ' CA ' ' A' ' 82' ' ' GLU . 0.4 OUTLIER -58.14 -56.09 26.53 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.034 -1.042 . . . . 0.0 109.948 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.445 HG23 HG13 ' A' ' 103' ' ' VAL . 55.4 t -53.78 -23.6 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.449 -0.782 . . . . 0.0 109.837 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 136' ' ' ASP . . . -76.22 -56.12 4.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.447 -0.783 . . . . 0.0 110.503 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.98 -34.16 54.67 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.342 -0.849 . . . . 0.0 110.582 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.495 ' CD1' HG21 ' A' ' 85' ' ' ILE . 0.2 OUTLIER -79.63 -58.95 2.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.188 -0.945 . . . . 0.0 110.451 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.497 ' NH1' ' HE3' ' A' ' 100' ' ' MET . 3.7 ttp180 -92.09 48.23 1.4 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.282 -0.886 . . . . 0.0 110.367 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' A' ' 132' ' ' ALA . 11.7 t70 -84.83 -43.05 14.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.197 -0.939 . . . . 0.0 110.224 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -119.16 -179.73 3.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.183 -0.948 . . . . 0.0 110.19 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -90.39 178.91 6.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.25 -0.906 . . . . 0.0 110.148 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -53.59 114.6 1.59 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.269 -0.894 . . . . 0.0 110.088 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.435 HD23 ' CG ' ' A' ' 143' ' ' GLU . 4.6 tp -164.05 128.54 2.75 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 110.294 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 142' ' ' GLU . 0.0 OUTLIER -91.62 167.33 12.29 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.298 -0.876 . . . . 0.0 110.074 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.459 ' CB ' ' O ' ' A' ' 141' ' ' ARG . 0.0 OUTLIER 65.55 61.55 0.69 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.178 -0.951 . . . . 0.0 110.193 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.435 ' CG ' HD23 ' A' ' 140' ' ' LEU . 8.4 mm-40 -140.87 60.3 1.52 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.201 -0.937 . . . . 0.0 110.23 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.41 ' OXT' ' CG ' ' A' ' 144' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.183 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.02 75.39 1.51 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.192 -1.181 . . . . 0.0 110.316 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' SER . . . . . 0.508 ' O ' ' CG ' ' A' ' 0' ' ' ARG . 0.9 OUTLIER -125.37 146.56 49.53 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.298 -0.876 . . . . 0.0 110.117 179.939 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . 0.508 ' CG ' ' O ' ' A' ' -1' ' ' SER . 0.0 OUTLIER 174.23 83.02 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.282 -0.886 . . . . 0.0 110.155 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -82.53 -8.36 59.61 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.257 -0.902 . . . . 0.0 110.297 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m -130.78 137.83 49.64 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.145 -0.972 . . . . 0.0 110.331 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.43 ' O ' ' CB ' ' A' ' 4' ' ' SER . 28.6 m -90.78 -17.88 25.87 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.232 -0.918 . . . . 0.0 110.257 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' A' ' 3' ' ' THR . 2.1 t 64.76 -175.29 0.17 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.204 -0.935 . . . . 0.0 110.173 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 6' ' ' LEU . 55.2 m -115.89 -70.37 0.8 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.921 . . . . 0.0 110.244 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.405 ' O ' ' O ' ' A' ' 5' ' ' SER . 0.2 OUTLIER 61.92 129.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.331 -0.855 . . . . 0.0 110.301 -179.995 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -86.04 44.6 1.14 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.26 -0.9 . . . . 0.0 110.23 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 56.9 ttt180 -45.66 -38.8 7.13 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 110.225 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -70.32 113.34 7.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.172 -0.955 . . . . 0.0 110.216 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 66.4 mtt -88.59 -168.96 2.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.245 -0.909 . . . . 0.0 110.239 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -78.28 -154.03 0.07 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.293 -0.879 . . . . 0.0 110.134 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.46 ' O ' ' O ' ' A' ' 13' ' ' ILE . 17.5 t-20 -168.75 50.86 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.193 -0.942 . . . . 0.0 110.244 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.46 ' O ' ' O ' ' A' ' 12' ' ' ASN . 20.4 mt 60.24 142.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.188 -0.945 . . . . 0.0 110.199 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.418 ' CG1' ' CE1' ' A' ' 17' ' ' TYR . 4.6 t -88.81 110.81 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.236 -0.915 . . . . 0.0 110.124 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -98.03 -146.81 0.32 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.203 -0.936 . . . . 0.0 110.295 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -83.57 84.07 7.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.235 -0.916 . . . . 0.0 110.49 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.478 ' CG ' ' O ' ' A' ' 17' ' ' TYR . 19.0 p90 -114.58 130.2 56.75 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.239 -0.913 . . . . 0.0 110.197 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.507 ' O ' ' CB ' ' A' ' 19' ' ' GLU . 15.0 t -145.77 -65.97 0.31 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.31 -0.869 . . . . 0.0 110.075 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.507 ' CB ' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER 166.38 -67.42 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.429 -0.795 . . . . 0.0 110.675 179.975 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.462 ' HA ' HD12 ' A' ' 46' ' ' LEU . . . -71.16 -55.23 8.58 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.193 -0.942 . . . . 0.0 110.625 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.442 ' HG3' HG12 ' A' ' 22' ' ' ILE . 19.7 pt-20 -41.01 -27.45 0.06 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.291 -0.881 . . . . 0.0 110.461 -179.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.443 ' N ' ' O ' ' A' ' 20' ' ' ALA . 23.5 mm -82.74 -57.81 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.271 -0.893 . . . . 0.0 110.308 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.434 ' HB3' HG13 ' A' ' 43' ' ' ILE . 26.2 mttt -53.9 -19.05 3.96 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.241 -0.912 . . . . 0.0 110.409 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.475 HG23 HG12 ' A' ' 43' ' ' ILE . 6.7 t -89.32 -37.39 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.204 -0.935 . . . . 0.0 110.12 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.501 ' NH2' ' NH1' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -64.66 -36.95 85.93 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.295 -0.878 . . . . 0.0 110.228 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -85.19 -40.56 16.55 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.273 -0.892 . . . . 0.0 110.259 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.523 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . . . -49.48 -38.51 30.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 0.0 110.174 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.467 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 63.6 p -94.16 50.03 1.36 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.307 -0.87 . . . . 0.0 110.25 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.442 ' HB2' ' O ' ' A' ' 28' ' ' THR . 46.6 t -178.17 -178.67 0.67 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.254 -0.904 . . . . 0.0 110.194 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.421 ' O ' ' OD1' ' A' ' 31' ' ' ASP . 17.5 m-80 -74.85 178.85 5.23 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.201 -0.937 . . . . 0.0 110.185 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 0.6 OUTLIER -143.61 169.22 10.85 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.267 -0.896 . . . . 0.0 110.253 -179.974 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.4 ' O ' ' C ' ' A' ' 33' ' ' TRP . 21.2 Cg_exo -61.16 -166.79 0.04 OUTLIER 'Trans proline' 0 C--N 1.307 -1.623 0 O-C-N 123.924 1.486 . . . . 0.0 110.376 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.4 ' C ' ' O ' ' A' ' 32' ' ' PRO . 0.7 OUTLIER -43.87 -38.16 3.2 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.188 -0.945 . . . . 0.0 110.398 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 136.83 77.42 0.08 OUTLIER Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -64.07 -57.4 0.34 Allowed 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 124.021 1.537 . . . . 0.0 110.268 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 p -151.44 -167.71 2.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.21 -0.931 . . . . 0.0 110.132 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.507 ' O ' ' N ' ' A' ' 39' ' ' LEU . 13.4 m -120.41 -34.73 3.57 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.198 -0.939 . . . . 0.0 110.303 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.8 p -48.59 90.77 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.254 -0.904 . . . . 0.0 110.244 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.523 ' CD1' ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -143.15 -38.0 0.35 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.28 -0.887 . . . . 0.0 110.319 -179.92 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.555 ' HG3' ' CG ' ' A' ' 83' ' ' TYR . 36.2 tpp -82.17 -60.14 2.32 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.532 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 7.8 t -56.89 -21.51 30.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.303 -0.873 . . . . 0.0 110.267 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -76.51 -55.78 5.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -0.906 . . . . 0.0 110.221 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.523 HD11 ' CD1' ' A' ' 39' ' ' LEU . 36.2 mt -49.03 -36.64 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.18 -0.95 . . . . 0.0 110.157 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.575 ' HB3' HD23 ' A' ' 84' ' ' LEU . . . -67.63 -55.0 15.04 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.204 -0.935 . . . . 0.0 109.489 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -50.08 -23.45 2.11 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.097 -1.002 . . . . 0.0 109.14 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.471 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 7.4 mt -79.1 -40.35 31.36 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.581 -0.699 . . . . 0.0 109.91 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.532 HG23 HG23 ' A' ' 92' ' ' VAL . 80.7 p -47.54 -39.71 17.07 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.177 -0.952 . . . . 0.0 109.174 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.575 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 57.9 m-85 -46.06 -50.3 15.36 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 119.384 -0.926 . . . . 0.0 109.289 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.529 ' O ' ' C ' ' A' ' 50' ' ' VAL . 16.5 m-20 -68.14 91.21 0.35 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.57 0.7 . . . . 0.0 110.765 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.529 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -11.0 -57.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.712 178.138 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.558 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -64.92 -66.25 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 120.928 -1.108 . . . . 0.0 110.301 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.558 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -37.57 -40.45 0.39 Allowed 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 121.146 0.498 . . . . 0.0 110.762 -177.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.573 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 15.1 t80 -59.07 -54.01 51.9 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.334 -0.854 . . . . 0.0 109.998 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.5 t -55.97 -33.22 64.58 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.19 -0.944 . . . . 0.0 109.862 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -75.42 -27.1 58.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.327 -0.858 . . . . 0.0 109.898 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.515 HG21 ' CD1' ' A' ' 84' ' ' LEU . 8.7 mt -79.68 -70.13 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.394 -0.816 . . . . 0.0 110.026 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.573 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 75.3 mmm -46.59 -36.35 6.8 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.274 -0.891 . . . . 0.0 109.563 179.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.4 m -55.16 -62.49 1.63 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.366 -0.834 . . . . 0.0 109.939 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.419 ' CA ' ' HE3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -59.35 -21.4 59.76 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.188 -0.945 . . . . 0.0 109.798 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.533 HD13 HD23 ' A' ' 80' ' ' LEU . 1.0 OUTLIER -76.08 -30.29 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.41 -0.806 . . . . 0.0 109.748 179.871 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.557 ' CE3' HD12 ' A' ' 64' ' ' LEU . 14.0 m95 -76.13 -46.73 27.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.307 -0.87 . . . . 0.0 110.346 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.3 mptt -55.84 -47.67 76.83 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.25 -0.906 . . . . 0.0 110.392 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.501 ' NH1' ' NH2' ' A' ' 25' ' ' ARG . 6.0 mmp_? -75.88 -10.9 59.81 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.326 -0.859 . . . . 0.0 110.338 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.699 HD23 HD13 ' A' ' 106' ' ' LEU . 6.6 mt -83.55 -17.68 40.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.194 -0.941 . . . . 0.0 110.351 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.472 ' O ' ' O ' ' A' ' 66' ' ' ASP . 14.5 m-20 -111.11 42.29 1.67 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.329 -0.857 . . . . 0.0 110.073 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.472 ' O ' ' O ' ' A' ' 65' ' ' ASN . 0.9 OUTLIER -53.85 -167.04 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.32 -0.862 . . . . 0.0 110.291 -179.921 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.413 ' O ' ' C ' ' A' ' 68' ' ' GLY . 12.9 p80 -162.72 -169.67 2.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.23 -0.919 . . . . 0.0 110.255 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.539 ' HA2' ' CE2' ' A' ' 111' ' ' TYR . . . 43.82 -121.04 3.43 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.2 ttpt -120.68 66.33 0.85 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.355 -1.086 . . . . 0.0 110.091 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -138.36 25.42 2.67 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.32 -0.862 . . . . 0.0 110.361 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.571 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 28.7 p-90 -55.03 -18.99 5.99 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 0.0 110.332 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.571 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 15.2 mtm-85 -48.85 -40.8 30.91 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.208 -0.933 . . . . 0.0 110.235 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.459 ' HB2' ' OD2' ' A' ' 66' ' ' ASP . 17.0 m170 -68.04 -47.81 67.37 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.234 -0.917 . . . . 0.0 110.094 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.544 HG13 ' HE2' ' A' ' 78' ' ' MET . 7.0 t -46.37 -52.42 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.349 -0.844 . . . . 0.0 110.172 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.53 ' CZ ' ' ND2' ' A' ' 122' ' ' ASN . 19.8 t80 -54.87 -49.05 72.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.342 -0.849 . . . . 0.0 110.33 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.467 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 10.9 mttm -61.92 -22.81 65.9 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.24 -0.913 . . . . 0.0 110.091 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.539 ' CB ' ' HG ' ' A' ' 64' ' ' LEU . . . -80.05 -23.92 41.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.239 -0.913 . . . . 0.0 109.936 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.544 ' HE2' HG13 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -73.81 -38.45 64.57 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.332 -0.855 . . . . 0.0 110.004 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.488 HG21 ' N ' ' A' ' 80' ' ' LEU . 8.9 t -72.1 -34.32 68.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.207 -0.933 . . . . 0.0 110.046 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.533 HD23 HD13 ' A' ' 60' ' ' ILE . 10.1 tp -68.41 -62.0 1.59 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.232 -0.917 . . . . 0.0 108.994 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.456 ' O ' HG13 ' A' ' 85' ' ' ILE . 2.9 ttm -53.69 -32.32 51.29 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.406 -0.808 . . . . 0.0 109.9 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.449 ' HG3' HD11 ' A' ' 130' ' ' LEU . 2.8 tt0 -72.74 -32.82 65.96 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.247 -0.908 . . . . 0.0 109.634 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.555 ' CG ' ' HG3' ' A' ' 40' ' ' MET . 20.9 t80 -70.75 -38.88 73.53 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.543 -0.723 . . . . 0.0 110.487 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.575 HD23 ' HB3' ' A' ' 44' ' ' ALA . 1.7 mt -70.55 -32.98 70.62 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.107 -0.995 . . . . 0.0 109.578 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.499 ' N ' HG12 ' A' ' 92' ' ' VAL . 71.5 mt -61.76 -26.34 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.181 -0.949 . . . . 0.0 110.082 179.654 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.02 -70.64 0.62 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.385 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.464 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 13.0 t -94.1 -23.05 18.12 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.236 -0.915 . . . . 0.0 110.4 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.575 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -44.36 -84.54 0.01 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.459 ' HB3' ' O ' ' A' ' 88' ' ' GLY . 14.4 p -178.09 156.37 1.02 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.234 -1.156 . . . . 0.0 110.31 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.78 -21.56 11.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.282 -0.886 . . . . 0.0 110.2 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -70.74 -44.84 65.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.928 . . . . 0.0 109.86 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.564 HG22 ' CE1' ' A' ' 53' ' ' PHE . 55.2 t -53.27 -38.45 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.361 -0.837 . . . . 0.0 109.958 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 96' ' ' CYS . 70.5 m -70.79 -41.06 72.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.316 -0.865 . . . . 0.0 109.98 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 31.3 mm-40 -57.07 -54.88 41.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.304 -0.872 . . . . 0.0 109.992 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.9 tp60 -55.86 -36.8 67.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.424 -0.797 . . . . 0.0 109.877 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 93' ' ' SER . 4.8 m -60.15 -36.37 77.38 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.315 -0.865 . . . . 0.0 109.736 179.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -74.92 -31.8 61.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.683 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 82.2 mt-10 -81.23 -14.78 57.13 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.473 -0.767 . . . . 0.0 110.027 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -123.18 32.87 5.54 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.281 -0.887 . . . . 0.0 110.174 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.6 ttm -58.2 -24.7 60.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.325 -0.86 . . . . 0.0 110.133 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.453 ' O ' ' HB ' ' A' ' 105' ' ' THR . 14.5 m-85 -69.07 -31.83 70.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.919 . . . . 0.0 110.104 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.527 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -75.08 -40.03 60.36 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.48 -0.763 . . . . 0.0 110.26 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.511 HG11 ' CG2' ' A' ' 131' ' ' VAL . 3.6 t -71.63 -32.37 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.418 -0.801 . . . . 0.0 110.14 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.419 ' HG3' HG23 ' A' ' 131' ' ' VAL . 77.3 mt-30 -86.0 -23.36 26.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.281 -0.887 . . . . 0.0 110.508 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.527 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 7.3 t -51.37 -25.69 6.49 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.082 -1.011 . . . . 0.0 110.002 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.699 HD13 HD23 ' A' ' 64' ' ' LEU . 50.5 mt -62.39 -43.55 98.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.309 -0.869 . . . . 0.0 110.077 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.471 ' HA ' ' HG2' ' A' ' 124' ' ' ARG . 49.0 mttt -43.73 -36.52 2.28 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.191 -0.943 . . . . 0.0 109.965 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.429 ' O ' ' N ' ' A' ' 110' ' ' GLN . 25.0 t0 -87.03 -31.81 20.34 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.401 -0.812 . . . . 0.0 110.196 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -47.59 97.65 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -0.87 . . . . 0.0 110.02 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.429 ' N ' ' O ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -138.66 151.7 47.42 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.318 -0.864 . . . . 0.0 110.188 -179.913 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.539 ' CE2' ' HA2' ' A' ' 68' ' ' GLY . 0.1 OUTLIER -153.91 105.39 2.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.357 -0.839 . . . . 0.0 110.049 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.48 ' O ' ' CG1' ' A' ' 112' ' ' VAL . 78.4 t -139.81 57.99 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.27 -0.894 . . . . 0.0 110.238 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -92.62 -42.37 9.69 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.172 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.585 ' CG ' ' N ' ' A' ' 115' ' ' ASP . 0.8 OUTLIER -99.9 -47.17 5.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.203 -0.935 . . . . 0.0 109.916 179.928 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.585 ' N ' ' CG ' ' A' ' 114' ' ' ARG . 6.5 m-20 -60.71 -28.31 68.55 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.525 -0.735 . . . . 0.0 110.124 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 54.01 28.07 39.65 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.93 102.8 1.3 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -1.16 . . . . 0.0 110.206 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -51.75 115.82 1.83 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.211 -0.93 . . . . 0.0 110.247 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -121.82 -12.94 8.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.27 -0.894 . . . . 0.0 110.251 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -93.83 46.66 2.28 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p -78.98 -41.35 23.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.272 -1.134 . . . . 0.0 110.056 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 3.7 t30 -36.12 -30.33 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.143 0.497 . . . . 0.0 110.582 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.525 HG11 ' CE ' ' A' ' 78' ' ' MET . 4.6 t -78.16 -58.45 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 0.0 109.826 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.471 ' HG2' ' HA ' ' A' ' 107' ' ' LYS . 10.4 mtp-105 -42.1 -47.29 4.52 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.243 -0.91 . . . . 0.0 111.038 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -72.28 -48.56 41.49 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.381 -0.825 . . . . 0.0 111.662 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.513 ' CE ' ' HA ' ' A' ' 126' ' ' LYS . 0.0 OUTLIER -52.04 -53.6 40.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.837 -1.164 . . . . 0.0 110.15 -179.278 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.418 ' HB1' ' HE3' ' A' ' 78' ' ' MET . . . -52.2 -43.25 64.1 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.341 -0.849 . . . . 0.0 110.146 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.3 tmmm? -55.21 -36.59 66.12 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.207 -0.933 . . . . 0.0 110.371 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -57.45 3.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.161 -0.962 . . . . 0.0 110.294 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.488 ' O ' ' CD2' ' A' ' 134' ' ' LEU . 12.2 tp -46.88 -25.5 0.78 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.208 -0.933 . . . . 0.0 110.041 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.511 ' CG2' HG11 ' A' ' 103' ' ' VAL . 30.0 t -86.64 -36.47 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.219 -0.925 . . . . 0.0 110.155 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.73 -60.46 3.07 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.218 -0.927 . . . . 0.0 110.22 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.98 -28.41 9.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.056 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.488 ' CD2' ' O ' ' A' ' 130' ' ' LEU . 0.8 OUTLIER -67.12 -57.82 6.07 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.28 -0.888 . . . . 0.0 110.261 179.924 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -86.35 96.03 9.85 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.288 -0.882 . . . . 0.0 110.336 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -117.34 -68.15 0.94 Allowed 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.243 -0.91 . . . . 0.0 110.214 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 49.21 92.15 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.262 -0.899 . . . . 0.0 110.252 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -169.06 139.85 2.35 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.249 -0.907 . . . . 0.0 110.203 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.28 131.77 42.33 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.233 -0.917 . . . . 0.0 110.174 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.63 -56.09 1.5 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 110.235 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.77 83.66 2.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.289 -0.882 . . . . 0.0 110.32 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.409 ' C ' ' OE1' ' A' ' 143' ' ' GLU . 0.5 OUTLIER -109.11 141.29 41.51 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.311 -0.868 . . . . 0.0 110.25 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.418 ' CD ' ' N ' ' A' ' 143' ' ' GLU . 5.5 pm0 -140.87 38.78 1.81 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.22 -0.925 . . . . 0.0 110.149 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.142 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' SER . . . . . 0.429 ' O ' ' CB ' ' A' ' -1' ' ' SER . 1.2 m 57.44 50.15 11.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -1.132 . . . . 0.0 110.221 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' -2' ' ' SER . 0.3 OUTLIER 64.98 78.54 0.28 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.281 -0.887 . . . . 0.0 110.234 179.952 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.54 121.89 22.78 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 110.21 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -156.15 -52.63 0.08 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 110.276 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.1 m -125.05 116.95 22.92 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.28 -0.888 . . . . 0.0 110.228 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.411 ' O ' HG21 ' A' ' 3' ' ' THR . 27.0 m -122.48 -7.95 8.61 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.344 -0.847 . . . . 0.0 110.215 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.2 p -86.26 -150.44 0.15 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.296 -0.877 . . . . 0.0 110.236 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 6' ' ' LEU . 53.4 p -157.22 148.88 22.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.298 -0.876 . . . . 0.0 110.16 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.414 ' O ' ' HD3' ' A' ' 8' ' ' ARG . 34.3 tp -179.21 -39.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.166 -0.959 . . . . 0.0 110.331 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.19 102.22 0.08 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.221 -0.924 . . . . 0.0 110.21 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.414 ' HD3' ' O ' ' A' ' 6' ' ' LEU . 5.8 mpt_? -68.42 168.09 13.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.202 -0.936 . . . . 0.0 110.197 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -51.12 119.73 4.28 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.251 -0.905 . . . . 0.0 110.351 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 23.2 mmt -100.75 -49.26 4.22 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.305 -0.872 . . . . 0.0 110.274 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -53.47 174.26 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.16 -0.962 . . . . 0.0 110.315 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.458 ' O ' ' HB ' ' A' ' 13' ' ' ILE . 52.9 p-10 -129.84 72.01 1.47 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.208 -0.932 . . . . 0.0 110.283 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.458 ' HB ' ' O ' ' A' ' 12' ' ' ASN . 26.1 mt 60.2 140.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.273 -0.892 . . . . 0.0 110.349 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 4.0 t -100.15 121.41 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.214 -0.929 . . . . 0.0 110.103 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.6 m170 -81.86 -16.58 50.27 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.258 -0.901 . . . . 0.0 110.18 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 44.78 45.48 8.31 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.322 -0.861 . . . . 0.0 110.226 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.537 ' CG ' ' O ' ' A' ' 17' ' ' TYR . 26.8 p90 -93.66 124.49 37.69 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.14 -0.975 . . . . 0.0 110.163 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 17' ' ' TYR . 17.9 t -177.08 45.66 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.28 -0.888 . . . . 0.0 110.171 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -136.65 -65.11 0.57 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.202 -0.936 . . . . 0.0 110.268 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.485 ' HB3' HD12 ' A' ' 46' ' ' LEU . . . -58.53 -46.42 86.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.378 -0.826 . . . . 0.0 110.286 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.474 ' OE2' ' CG1' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -43.71 -28.28 0.4 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.14 -0.975 . . . . 0.0 110.081 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.474 ' CG1' ' OE2' ' A' ' 21' ' ' GLU . 9.9 mt -86.76 -54.08 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.291 -0.881 . . . . 0.0 110.133 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.523 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 0.0 OUTLIER -44.6 -37.87 3.88 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 110.153 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.549 HG23 HG22 ' A' ' 56' ' ' ILE . 51.2 t -75.06 -48.57 31.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.232 -0.917 . . . . 0.0 110.145 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -46.66 -41.19 14.42 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.136 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.461 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -74.05 -47.46 36.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.333 -0.855 . . . . 0.0 110.107 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.537 ' HB3' ' CD2' ' A' ' 39' ' ' LEU . . . -44.44 -47.17 9.88 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.235 -0.916 . . . . 0.0 110.078 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.436 ' HA ' ' HB2' ' A' ' 76' ' ' LYS . 39.5 p -74.3 -31.19 62.39 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.32 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 51.5 m -68.68 162.29 26.39 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.256 -0.902 . . . . 0.0 110.137 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -48.43 169.08 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.203 -0.936 . . . . 0.0 110.139 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -114.85 104.73 53.97 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.21 -0.931 . . . . 0.0 110.228 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -55.67 -163.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 124.069 1.562 . . . . 0.0 110.341 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.1 m95 -96.28 174.78 6.71 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.21 -0.931 . . . . 0.0 110.454 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 120.73 99.72 1.71 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -57.6 -61.5 0.29 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 124.027 1.54 . . . . 0.0 110.298 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.6 m -66.97 94.68 0.34 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.916 . . . . 0.0 110.065 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 96.1 p -144.33 166.74 24.23 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.199 -0.938 . . . . 0.0 110.238 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -172.29 97.0 0.15 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.295 -0.878 . . . . 0.0 110.13 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.537 ' CD2' ' HB3' ' A' ' 27' ' ' ALA . 0.8 OUTLIER -118.82 -22.31 7.43 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.167 -0.958 . . . . 0.0 110.25 -179.942 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -50.67 22.71 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 110.218 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.454 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 89.0 p -58.47 -29.19 65.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -73.11 -47.65 42.47 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.266 -0.896 . . . . 0.0 110.241 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.536 ' CG2' HD13 ' A' ' 80' ' ' LEU . 23.1 mt -57.68 -38.65 65.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.233 -0.917 . . . . 0.0 110.226 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.523 ' HB1' HD23 ' A' ' 84' ' ' LEU . . . -68.61 -47.18 67.34 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.058 -1.027 . . . . 0.0 109.43 179.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.475 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 3.6 t70 -55.41 -18.48 6.94 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.117 -0.99 . . . . 0.0 109.12 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.485 HD12 ' HB3' ' A' ' 20' ' ' ALA . 24.7 mt -85.22 -33.52 22.22 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.531 -0.73 . . . . 0.0 110.191 179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.528 ' HA ' ' CA ' ' A' ' 53' ' ' PHE . 38.9 p -56.08 -43.74 78.31 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.0 -1.062 . . . . 0.0 109.233 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.544 ' CE2' ' O ' ' A' ' 87' ' ' THR . 95.0 m-85 -41.26 -37.51 0.97 Allowed 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.59 179.537 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.542 ' O ' ' C ' ' A' ' 50' ' ' VAL . 0.8 OUTLIER -80.66 91.21 5.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.591 -0.693 . . . . 0.0 110.365 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.542 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.09 -58.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.26 178.095 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.547 HG11 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -65.11 -66.03 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.032 -1.042 . . . . 0.0 110.143 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.547 ' N ' HG11 ' A' ' 51' ' ' VAL . . . -38.19 -44.5 0.86 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.295 0.569 . . . . 0.0 110.522 -177.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.528 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 0.6 OUTLIER -56.73 -55.85 28.88 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.425 -0.797 . . . . 0.0 109.925 179.715 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -54.67 -31.81 58.29 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.194 -0.941 . . . . 0.0 110.232 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -77.79 -26.94 50.04 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.307 -0.871 . . . . 0.0 110.193 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.549 HG22 HG23 ' A' ' 24' ' ' VAL . 6.3 mt -78.36 -70.3 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.326 -0.859 . . . . 0.0 110.216 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.446 ' SD ' ' HB3' ' A' ' 95' ' ' GLN . 3.5 mtp -46.64 -35.48 6.0 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.177 -0.952 . . . . 0.0 109.762 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 t -55.85 -60.97 2.7 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.258 -0.901 . . . . 0.0 109.659 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.45 -20.14 58.86 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.266 -0.897 . . . . 0.0 109.679 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.581 ' CG1' ' CD2' ' A' ' 80' ' ' LEU . 1.2 mt -75.67 -31.18 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.413 -0.804 . . . . 0.0 109.645 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.402 ' CE3' HD13 ' A' ' 64' ' ' LEU . 17.3 m95 -74.74 -50.27 18.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -0.906 . . . . 0.0 110.202 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -56.14 18.4 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.249 -0.907 . . . . 0.0 110.327 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -68.61 -14.18 62.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.246 -0.909 . . . . 0.0 110.427 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.626 HD21 ' CD1' ' A' ' 106' ' ' LEU . 4.1 mt -77.69 -25.25 49.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.22 -0.925 . . . . 0.0 110.569 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.462 ' O ' ' O ' ' A' ' 66' ' ' ASP . 1.4 m120 -113.83 43.15 1.87 Allowed 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.343 -0.848 . . . . 0.0 110.185 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.463 ' OD1' HG21 ' A' ' 74' ' ' VAL . 2.3 p-10 -56.03 -159.96 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.353 -0.842 . . . . 0.0 110.427 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.554 ' CD2' ' HB2' ' A' ' 69' ' ' LYS . 0.8 OUTLIER -108.53 -167.37 1.22 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.135 -0.978 . . . . 0.0 110.387 179.974 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -85.91 60.55 4.62 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.554 ' HB2' ' CD2' ' A' ' 67' ' ' HIS . 0.4 OUTLIER -149.93 -74.62 0.16 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.322 -1.105 . . . . 0.0 110.197 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -99.02 50.06 0.96 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.341 -0.849 . . . . 0.0 110.492 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.478 ' CZ2' ' HG3' ' A' ' 119' ' ' GLN . 0.6 OUTLIER -58.01 -14.09 5.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.116 -0.99 . . . . 0.0 110.25 179.816 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -47.5 -35.82 9.37 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.161 -0.962 . . . . 0.0 109.592 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -61.73 -47.86 83.33 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.343 -0.848 . . . . 0.0 109.742 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.538 HG12 ' CG1' ' A' ' 123' ' ' VAL . 58.9 t -50.67 -46.19 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.331 -0.855 . . . . 0.0 109.715 179.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.518 ' CA ' HG21 ' A' ' 123' ' ' VAL . 8.4 t80 -57.18 -52.18 66.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.321 -0.862 . . . . 0.0 109.804 179.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.446 ' O ' HG22 ' A' ' 79' ' ' THR . 25.9 mmmt -62.54 -19.37 63.59 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.298 -0.877 . . . . 0.0 109.768 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.542 ' HB1' HD23 ' A' ' 64' ' ' LEU . . . -79.48 -30.97 42.28 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.399 -0.813 . . . . 0.0 109.927 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.508 ' HE3' ' CG1' ' A' ' 74' ' ' VAL . 1.2 mpp? -68.36 -46.47 70.01 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 109.859 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 76' ' ' LYS . 14.8 t -67.57 -31.86 72.22 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.249 -0.907 . . . . 0.0 109.808 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.581 ' CD2' ' CG1' ' A' ' 60' ' ' ILE . 11.2 tp -66.3 -65.4 0.68 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.347 -0.846 . . . . 0.0 109.033 178.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.514 ' HG2' ' CD2' ' A' ' 130' ' ' LEU . 9.3 ttt -49.38 -32.75 12.1 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.406 -0.809 . . . . 0.0 110.122 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -70.36 -38.07 74.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.102 -0.999 . . . . 0.0 110.025 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.574 ' CE1' HG23 ' A' ' 87' ' ' THR . 19.7 t80 -68.21 -34.31 76.01 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.255 -0.903 . . . . 0.0 110.677 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 84' ' ' LEU . 2.8 mt -80.76 -21.79 40.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.019 -1.051 . . . . 0.0 109.924 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.575 HG23 HD11 ' A' ' 134' ' ' LEU . 19.9 mt -65.93 -24.64 34.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.154 -0.966 . . . . 0.0 109.534 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -103.31 -61.38 1.42 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.361 -0.837 . . . . 0.0 109.901 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.574 HG23 ' CE1' ' A' ' 83' ' ' TYR . 11.0 t -98.34 11.39 38.18 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.299 -0.876 . . . . 0.0 109.974 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.528 ' HA3' ' CA ' ' A' ' 84' ' ' LEU . . . -102.2 29.69 11.96 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 72.6 153.32 0.13 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.391 -1.064 . . . . 0.0 110.43 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.78 -8.71 22.88 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.367 -0.833 . . . . 0.0 110.378 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.417 ' O ' ' HB2' ' A' ' 94' ' ' GLN . 10.4 mmp_? -70.96 -45.07 64.75 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.284 -0.885 . . . . 0.0 109.842 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.537 HG13 ' N ' ' A' ' 85' ' ' ILE . 91.0 t -52.45 -47.09 47.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 O-C-N 121.409 -0.807 . . . . 0.0 109.898 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.8 t -64.55 -36.78 85.34 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.215 -0.928 . . . . 0.0 109.92 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 56.3 mm-40 -58.08 -46.65 85.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.248 -0.908 . . . . 0.0 109.844 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.446 ' HB3' ' SD ' ' A' ' 57' ' ' MET . 0.1 OUTLIER -60.25 -39.82 88.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.835 . . . . 0.0 109.59 179.415 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 51.5 t -55.02 -40.82 70.59 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.364 -0.835 . . . . 0.0 109.564 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -29.58 64.75 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.48 -0.763 . . . . 0.0 109.669 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 0.5 OUTLIER -81.83 -12.52 58.46 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.479 -0.763 . . . . 0.0 110.006 179.788 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.419 ' OD1' ' O ' ' A' ' 98' ' ' GLU . 70.4 m-20 -137.15 42.18 2.42 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.309 -0.869 . . . . 0.0 110.047 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.471 ' HE1' ' NH2' ' A' ' 141' ' ' ARG . 0.4 OUTLIER -59.75 -35.67 75.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.272 -0.893 . . . . 0.0 110.237 -179.959 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.456 ' O ' ' HB ' ' A' ' 105' ' ' THR . 25.4 m-85 -60.97 -25.88 67.16 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.387 -0.821 . . . . 0.0 110.145 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.504 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -74.54 -40.82 61.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.332 -0.855 . . . . 0.0 110.159 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.431 HG13 HG23 ' A' ' 131' ' ' VAL . 3.0 t -74.57 -26.52 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.337 -0.852 . . . . 0.0 110.049 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -88.59 -24.02 22.96 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.303 -0.873 . . . . 0.0 110.405 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.504 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 14.0 t -61.79 -23.75 66.41 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.129 -0.982 . . . . 0.0 110.147 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.626 ' CD1' HD21 ' A' ' 64' ' ' LEU . 10.6 mt -70.44 -40.44 73.76 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 110.085 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.44 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 0.1 OUTLIER -47.58 -36.1 10.15 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 110.349 179.969 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -91.37 -23.34 20.1 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.376 -0.827 . . . . 0.0 110.288 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -58.03 119.76 7.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.242 -0.911 . . . . 0.0 110.222 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.45 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 0.0 OUTLIER -160.21 140.86 11.91 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.24 -0.912 . . . . 0.0 110.18 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -161.66 116.43 1.99 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.236 -0.915 . . . . 0.0 110.39 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.501 ' CG1' ' O ' ' A' ' 117' ' ' LYS . 94.8 t -135.36 62.32 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.26 -0.9 . . . . 0.0 109.996 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 112' ' ' VAL . 3.0 m-20 60.26 178.91 0.09 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.28 -0.887 . . . . 0.0 110.143 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.19 -47.77 54.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.215 -0.928 . . . . 0.0 110.133 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -159.02 70.45 0.49 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.41 -0.806 . . . . 0.0 110.143 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -101.63 -133.22 8.01 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.501 ' O ' ' CG1' ' A' ' 112' ' ' VAL . 9.9 mtmm -96.54 -150.35 0.33 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.246 -1.15 . . . . 0.0 110.313 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -140.78 72.09 1.38 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.291 -0.88 . . . . 0.0 110.143 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.478 ' HG3' ' CZ2' ' A' ' 71' ' ' TRP . 0.1 OUTLIER -94.25 23.51 5.05 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.217 -0.927 . . . . 0.0 110.18 -179.994 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -104.54 15.17 49.95 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.6 p -82.55 -44.13 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.228 -1.16 . . . . 0.0 110.03 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 6.5 t30 -43.29 -45.7 6.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.379 -0.825 . . . . 0.0 110.344 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.538 ' CG1' HG12 ' A' ' 74' ' ' VAL . 1.2 t -82.2 -37.25 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.196 -0.94 . . . . 0.0 110.059 -179.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.44 ' HG3' ' HA ' ' A' ' 107' ' ' LYS . 31.1 ttp180 -53.6 -61.5 2.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.08 -1.012 . . . . 0.0 110.837 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 78.9 mt-10 -65.76 -40.65 92.28 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.351 -0.843 . . . . 0.0 111.259 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 11.2 tptm -52.68 -51.06 61.89 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.073 -1.017 . . . . 0.0 110.203 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.474 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -58.73 -45.54 89.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.378 -0.826 . . . . 0.0 109.958 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.0 tttm -49.66 -46.41 49.68 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.264 -0.897 . . . . 0.0 109.917 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.64 -51.01 68.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.318 -0.864 . . . . 0.0 110.091 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.53 HD11 ' CD1' ' A' ' 85' ' ' ILE . 20.5 tp -47.61 -30.69 3.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.214 -0.929 . . . . 0.0 110.04 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 28.2 t -81.52 -34.76 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.332 -0.855 . . . . 0.0 110.287 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.438 ' O ' ' N ' ' A' ' 134' ' ' LEU . . . -71.52 -60.36 2.27 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.324 -0.86 . . . . 0.0 110.539 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 132' ' ' ALA . 0.8 OUTLIER -42.1 -26.77 0.11 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 110.387 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.575 HD11 HG23 ' A' ' 85' ' ' ILE . 0.3 OUTLIER -89.73 -38.47 13.81 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.279 -0.888 . . . . 0.0 110.211 179.978 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -106.35 47.49 0.88 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.239 -0.913 . . . . 0.0 110.103 179.873 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -79.12 -53.63 6.8 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.285 -0.884 . . . . 0.0 110.312 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -81.22 149.11 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.293 -0.879 . . . . 0.0 110.314 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.4 t70 61.11 42.52 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.272 -0.892 . . . . 0.0 110.394 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -23.29 64.04 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.187 -0.946 . . . . 0.0 110.128 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.5 103.68 0.55 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.209 -0.932 . . . . 0.0 110.179 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.471 ' NH2' ' HE1' ' A' ' 100' ' ' MET . 0.2 OUTLIER -110.91 61.17 0.61 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.298 -0.876 . . . . 0.0 110.155 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.07 107.87 0.13 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.271 -0.893 . . . . 0.0 110.229 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -129.45 -42.23 1.33 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.209 -0.932 . . . . 0.0 110.229 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.229 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.3 127.17 48.17 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.235 -1.156 . . . . 0.0 110.279 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 1.5 m -143.99 28.3 1.4 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.23 -0.919 . . . . 0.0 110.162 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -164.92 67.19 0.14 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.21 -0.932 . . . . 0.0 110.181 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.61 -4.11 29.13 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 110.207 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.1 p -155.21 -174.3 4.92 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.263 -0.898 . . . . 0.0 110.157 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.407 ' O ' ' CG2' ' A' ' 3' ' ' THR . 11.6 t -152.58 63.52 0.8 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.171 -0.955 . . . . 0.0 110.137 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -137.44 -171.88 3.08 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.0 110.238 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -137.74 159.25 42.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.278 -0.889 . . . . 0.0 110.012 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.6 mt 49.33 80.79 0.06 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.172 -0.955 . . . . 0.0 110.076 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -123.39 -19.19 5.99 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.379 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 9' ' ' GLN . 0.0 OUTLIER -171.94 -48.2 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.242 -0.911 . . . . 0.0 110.308 -179.929 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.453 ' C ' ' O ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER 38.92 42.64 0.67 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.392 -0.818 . . . . 0.0 110.85 179.604 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.36 170.16 12.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.148 -0.97 . . . . 0.0 110.036 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.77 -157.34 0.43 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.153 -0.967 . . . . 0.0 110.24 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -149.61 138.24 20.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.368 -0.833 . . . . 0.0 110.094 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.437 ' O ' ' O ' ' A' ' 14' ' ' VAL . 24.0 mt -72.16 152.77 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.114 -0.991 . . . . 0.0 110.162 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.437 ' O ' ' O ' ' A' ' 13' ' ' ILE . 21.5 t -43.45 166.22 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.231 -0.918 . . . . 0.0 110.304 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 20.0 m80 -99.58 -31.8 11.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.283 -0.885 . . . . 0.0 110.063 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -91.87 142.12 27.91 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.2 -0.938 . . . . 0.0 110.158 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -72.78 158.18 36.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.186 -0.946 . . . . 0.0 110.241 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -172.71 37.16 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 110.153 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -107.11 34.14 3.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.266 -0.896 . . . . 0.0 110.22 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.549 ' HB1' HD11 ' A' ' 46' ' ' LEU . . . -68.55 -41.04 80.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.272 -0.893 . . . . 0.0 110.191 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.451 ' HG3' HG13 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -55.11 -25.86 34.35 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.281 -0.887 . . . . 0.0 110.248 -180.0 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.452 HD11 HG21 ' A' ' 22' ' ' ILE . 40.8 mt -80.47 -44.9 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.258 -0.901 . . . . 0.0 110.273 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.509 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 2.1 mtmm -62.75 -32.18 73.26 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.238 -0.914 . . . . 0.0 110.122 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.54 HG23 HG21 ' A' ' 56' ' ' ILE . 33.1 t -71.24 -41.32 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.309 -0.869 . . . . 0.0 110.11 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -56.9 -42.49 79.99 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 110.027 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -72.97 -38.15 66.81 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.376 -0.827 . . . . 0.0 110.056 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.51 ' CB ' ' CD2' ' A' ' 39' ' ' LEU . . . -63.96 -22.16 66.8 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.304 -0.873 . . . . 0.0 110.094 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.484 ' CG2' ' HA ' ' A' ' 77' ' ' ALA . 13.2 p -103.47 35.22 2.66 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.259 -0.901 . . . . 0.0 110.17 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.96 107.4 0.05 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.231 -0.918 . . . . 0.0 110.123 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -119.83 -59.8 1.77 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.251 -0.906 . . . . 0.0 110.253 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.417 ' CB ' ' CD ' ' A' ' 32' ' ' PRO . 0.2 OUTLIER 61.31 -179.95 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.223 -0.923 . . . . 0.0 110.076 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.436 ' O ' ' C ' ' A' ' 33' ' ' TRP . 23.4 Cg_exo -59.4 174.24 1.15 Allowed 'Trans proline' 0 C--N 1.306 -1.683 0 O-C-N 123.987 1.519 . . . . 0.0 110.32 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.436 ' C ' ' O ' ' A' ' 32' ' ' PRO . 0.8 OUTLIER 41.07 -159.14 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.423 -0.798 . . . . 0.0 110.598 179.931 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.79 138.58 4.79 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -68.64 151.8 74.81 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 123.971 1.511 . . . . 0.0 110.402 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.4 ' O ' ' HB3' ' A' ' 37' ' ' SER . 10.4 m -115.83 149.26 38.88 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.247 -0.908 . . . . 0.0 110.129 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.4 ' HB3' ' O ' ' A' ' 36' ' ' SER . 1.4 p -178.58 160.76 1.25 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.935 . . . . 0.0 110.256 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.4 m -60.21 96.92 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.348 -0.845 . . . . 0.0 110.195 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.51 ' CD2' ' CB ' ' A' ' 27' ' ' ALA . 0.5 OUTLIER -110.48 -10.55 14.55 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.164 -0.96 . . . . 0.0 110.215 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 4.2 mmt -86.88 -47.64 8.84 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 110.201 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.507 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 7.2 t -57.87 -19.78 31.88 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.266 -0.896 . . . . 0.0 110.143 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.414 ' OE2' ' HD3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -82.0 -58.13 3.1 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.237 -0.915 . . . . 0.0 110.192 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.525 ' CD1' HD11 ' A' ' 80' ' ' LEU . 96.4 mt -50.41 -35.56 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.163 -0.961 . . . . 0.0 109.937 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.538 ' HB3' HD23 ' A' ' 84' ' ' LEU . . . -67.32 -54.27 22.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.317 -0.864 . . . . 0.0 109.509 179.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.1 -21.88 3.65 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.159 -0.963 . . . . 0.0 108.988 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.549 HD11 ' HB1' ' A' ' 20' ' ' ALA . 14.1 mt -81.73 -37.83 26.68 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.574 -0.704 . . . . 0.0 109.927 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.543 HG21 HG23 ' A' ' 92' ' ' VAL . 80.6 p -49.77 -40.91 42.83 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.071 -1.018 . . . . 0.0 109.243 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.587 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 72.4 m-85 -44.39 -47.09 9.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.233 -0.917 . . . . 0.0 109.317 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.547 ' O ' ' C ' ' A' ' 50' ' ' VAL . 2.8 m120 -70.14 90.71 0.67 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.707 -0.621 . . . . 0.0 110.432 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.547 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.58 -58.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.269 178.099 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.547 HG13 ' N ' ' A' ' 52' ' ' ALA . 2.6 t -61.75 -64.4 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.096 -1.002 . . . . 0.0 109.943 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.547 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -37.89 -45.24 0.84 Allowed 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.759 -177.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.586 ' CE1' ' HA ' ' A' ' 92' ' ' VAL . 20.6 t80 -60.99 -53.95 50.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.292 -0.88 . . . . 0.0 110.166 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.52 -30.29 40.82 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.291 -0.88 . . . . 0.0 109.946 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -80.15 -29.38 38.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.428 -0.795 . . . . 0.0 110.01 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.54 HG21 HG23 ' A' ' 24' ' ' VAL . 10.3 mt -77.79 -69.63 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.356 -0.84 . . . . 0.0 110.09 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.507 ' CE ' ' HG3' ' A' ' 95' ' ' GLN . 0.2 OUTLIER -45.96 -35.45 4.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.27 -0.894 . . . . 0.0 110.111 179.732 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.5 t -58.36 -66.09 0.54 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.279 -0.888 . . . . 0.0 110.197 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.09 -17.24 16.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.301 -0.875 . . . . 0.0 109.986 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.545 HG21 HD11 ' A' ' 64' ' ' LEU . 0.7 OUTLIER -79.12 -33.15 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.37 -0.831 . . . . 0.0 109.813 179.809 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.551 ' CZ3' ' HE2' ' A' ' 81' ' ' MET . 12.2 m95 -75.74 -41.78 52.39 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.251 -0.905 . . . . 0.0 110.111 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.1 -57.7 11.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.306 -0.871 . . . . 0.0 110.13 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -66.88 -11.57 56.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 110.12 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.683 HD23 HD11 ' A' ' 106' ' ' LEU . 3.7 mt -80.32 -22.19 41.75 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.197 -0.94 . . . . 0.0 110.265 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.408 ' O ' ' O ' ' A' ' 66' ' ' ASP . 2.9 t30 -101.2 36.32 2.02 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.243 -0.911 . . . . 0.0 109.966 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.441 ' O ' ' CZ ' ' A' ' 109' ' ' PHE . 0.2 OUTLIER -57.21 -162.96 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.288 -0.883 . . . . 0.0 110.323 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.0 m80 -101.32 173.73 6.31 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.313 -0.867 . . . . 0.0 110.316 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.486 ' HA3' ' CB ' ' A' ' 111' ' ' TYR . . . -62.22 -68.81 1.51 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.1 ttpm? -51.82 -26.77 10.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.233 -1.157 . . . . 0.0 110.172 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -105.74 45.65 0.96 Allowed 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.281 -0.887 . . . . 0.0 110.312 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.46 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 64.9 p-90 -76.09 -19.62 58.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.176 -0.953 . . . . 0.0 110.238 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -43.98 -49.84 8.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.257 -0.902 . . . . 0.0 110.108 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -54.08 -49.1 69.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 110.2 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.581 ' CG1' ' CG2' ' A' ' 123' ' ' VAL . 25.0 t -49.48 -49.95 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.325 -0.86 . . . . 0.0 110.278 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.62 ' CE1' ' CD ' ' A' ' 126' ' ' LYS . 6.7 t80 -47.08 -55.25 8.65 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.284 -0.885 . . . . 0.0 110.586 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.447 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -66.88 -23.86 66.05 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.107 -0.996 . . . . 0.0 110.513 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.533 ' HB3' HD22 ' A' ' 64' ' ' LEU . . . -68.89 -68.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.234 -0.916 . . . . 0.0 110.378 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.53 ' HE2' HG12 ' A' ' 74' ' ' VAL . 0.3 OUTLIER -49.63 -31.96 11.93 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.381 -0.824 . . . . 0.0 110.192 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.7 m -55.27 -56.3 21.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.14 -0.975 . . . . 0.0 109.646 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.529 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 29.7 tp -51.6 -66.62 0.35 Allowed 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.329 -0.857 . . . . 0.0 108.818 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.551 ' HE2' ' CZ3' ' A' ' 61' ' ' TRP . 47.3 ttm -41.32 -28.49 0.11 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.444 -0.785 . . . . 0.0 110.418 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.513 ' N ' HD11 ' A' ' 130' ' ' LEU . 0.2 OUTLIER -72.3 -47.08 52.71 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.21 -0.931 . . . . 0.0 110.529 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.572 ' CE1' HG22 ' A' ' 87' ' ' THR . 33.6 t80 -70.54 -30.53 67.29 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.236 -0.915 . . . . 0.0 111.355 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.538 HD23 ' HB3' ' A' ' 44' ' ' ALA . 6.7 mt -75.26 -33.29 61.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.941 -1.1 . . . . 0.0 110.521 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.522 ' CD1' HD23 ' A' ' 130' ' ' LEU . 53.7 mt -62.15 -29.76 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 120.995 -1.065 . . . . 0.0 110.352 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.7 tttt -85.89 -71.13 0.55 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.245 -0.909 . . . . 0.0 110.541 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.572 HG22 ' CE1' ' A' ' 83' ' ' TYR . 11.0 t -94.34 -20.43 19.76 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.198 -0.938 . . . . 0.0 110.446 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.587 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -49.32 -66.4 2.25 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 3.5 t 171.98 158.21 0.09 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.099 -1.236 . . . . 0.0 110.256 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -63.46 -12.91 35.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.293 -0.879 . . . . 0.0 110.263 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.452 ' HD3' ' O ' ' A' ' 47' ' ' THR . 3.9 ptm85 -84.67 -29.18 25.86 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -0.903 . . . . 0.0 110.237 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.586 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 59.9 t -67.65 -31.46 52.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.194 -0.941 . . . . 0.0 109.818 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 83.7 p -80.0 -39.19 30.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.324 -0.86 . . . . 0.0 109.712 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -61.58 -51.23 69.41 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.309 -0.87 . . . . 0.0 109.773 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.507 ' HG3' ' CE ' ' A' ' 57' ' ' MET . 5.3 tp-100 -57.67 -40.1 78.58 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.455 -0.778 . . . . 0.0 109.536 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 8.5 t -55.62 -37.87 68.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -0.873 . . . . 0.0 109.54 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.93 -32.61 67.5 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.437 -0.789 . . . . 0.0 109.705 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -71.16 -24.09 62.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.443 -0.786 . . . . 0.0 109.801 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.76 36.04 4.71 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.44 -0.788 . . . . 0.0 110.106 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.438 ' O ' HG12 ' A' ' 103' ' ' VAL . 0.3 OUTLIER -59.69 -20.67 57.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.333 -0.854 . . . . 0.0 110.271 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.437 ' O ' ' HB ' ' A' ' 105' ' ' THR . 55.1 m-85 -76.24 -28.46 57.16 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.193 -0.942 . . . . 0.0 110.227 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.54 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -76.71 -39.03 53.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 110.222 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.579 ' CG1' ' N ' ' A' ' 104' ' ' GLN . 3.2 p -74.71 -42.03 47.75 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 CA-C-O 121.942 0.877 . . . . 0.0 109.08 179.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.579 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 14.3 mm100 -70.04 -21.78 63.15 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.556 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.54 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 4.7 t -57.47 -16.08 8.64 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.986 -1.072 . . . . 0.0 109.994 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.683 HD11 HD23 ' A' ' 64' ' ' LEU . 76.4 mt -74.99 -37.42 61.87 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.263 -0.898 . . . . 0.0 110.382 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 104' ' ' GLN . 2.8 pttp -54.47 -18.3 4.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.223 -0.923 . . . . 0.0 110.136 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.445 ' OD2' ' HE3' ' A' ' 107' ' ' LYS . 57.6 m-20 -117.68 -12.32 10.29 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.225 -0.922 . . . . 0.0 110.222 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.441 ' CZ ' ' O ' ' A' ' 66' ' ' ASP . 0.3 OUTLIER -68.49 97.25 0.75 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.305 -0.872 . . . . 0.0 110.321 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -135.98 156.33 48.9 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.262 -0.899 . . . . 0.0 110.076 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.486 ' CB ' ' HA3' ' A' ' 68' ' ' GLY . 0.3 OUTLIER -165.13 107.54 0.82 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.234 -0.917 . . . . 0.0 110.251 -179.926 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 118' ' ' ASP . 12.9 t -127.23 43.53 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.283 -0.886 . . . . 0.0 110.185 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 52.95 -176.48 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.275 -0.891 . . . . 0.0 110.214 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.78 -46.42 59.52 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.229 -0.92 . . . . 0.0 110.242 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -154.69 110.63 3.19 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.158 -0.964 . . . . 0.0 110.272 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.404 ' CA ' HG13 ' A' ' 112' ' ' VAL . . . -148.4 -154.17 6.21 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -96.74 130.23 44.01 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.215 -1.168 . . . . 0.0 110.124 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.434 ' HA ' HG22 ' A' ' 112' ' ' VAL . 19.2 p-10 -62.56 113.7 3.12 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.273 -0.892 . . . . 0.0 110.401 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -130.57 38.62 3.71 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.256 -0.902 . . . . 0.0 110.136 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -120.22 6.83 11.79 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.646 -1.381 . . . . 0.0 109.646 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.557 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.4 p -74.65 -42.49 48.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.23 -1.159 . . . . 0.0 109.954 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.557 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 37.8 m-80 -47.77 -60.32 2.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.434 -0.791 . . . . 0.0 110.282 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.581 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 14.9 p -72.46 -13.09 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.245 -0.909 . . . . 0.0 110.494 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.473 ' HB3' ' O ' ' A' ' 121' ' ' VAL . 6.4 ttt180 -74.25 -69.02 0.47 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.14 -0.975 . . . . 0.0 110.563 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.46 -34.92 71.39 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.327 -0.858 . . . . 0.0 110.644 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.62 ' CD ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -58.31 -56.56 20.51 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.036 -1.04 . . . . 0.0 109.885 179.978 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.454 ' HB2' ' HE3' ' A' ' 78' ' ' MET . . . -54.5 -44.88 73.1 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 109.93 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' A' ' 124' ' ' ARG . 11.2 mtpt -57.29 -35.13 69.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.272 -0.893 . . . . 0.0 110.244 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -59.44 -48.29 82.22 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.295 -0.878 . . . . 0.0 110.422 -179.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.522 HD23 ' CD1' ' A' ' 85' ' ' ILE . 3.8 tt -55.19 -51.63 65.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.197 -0.939 . . . . 0.0 110.264 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.484 ' CG2' ' CG1' ' A' ' 103' ' ' VAL . 96.0 t -63.75 -26.89 41.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.423 -0.798 . . . . 0.0 110.387 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.97 -47.03 79.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.278 -0.889 . . . . 0.0 110.186 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 mt -58.01 -48.87 78.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.265 -0.897 . . . . 0.0 110.406 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.476 HD12 ' CG2' ' A' ' 85' ' ' ILE . 9.6 mp -67.68 -15.62 63.74 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.218 -0.926 . . . . 0.0 110.383 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.8 ttt-85 -110.66 51.8 0.75 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.182 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.47 ' O ' ' CB ' ' A' ' 137' ' ' GLU . 0.8 OUTLIER -152.18 -61.94 0.16 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.212 -0.93 . . . . 0.0 110.217 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.47 ' CB ' ' O ' ' A' ' 136' ' ' ASP . 0.0 OUTLIER 66.74 147.09 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.242 -0.911 . . . . 0.0 110.25 179.991 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.04 168.58 20.79 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.21 -0.931 . . . . 0.0 110.237 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.3 ptt180 -59.6 148.63 32.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.24 -0.912 . . . . 0.0 110.151 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -98.69 81.75 2.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.228 -0.92 . . . . 0.0 110.341 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.91 60.58 0.86 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.335 -0.853 . . . . 0.0 110.146 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -158.12 151.99 23.89 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.223 -0.923 . . . . 0.0 110.27 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -144.29 -69.12 0.31 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.197 -0.939 . . . . 0.0 110.246 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 118.045 -0.979 . . . . 0.0 110.21 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.27 61.34 1.68 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.224 -1.162 . . . . 0.0 110.22 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 69.2 m -96.79 29.93 2.84 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.259 -0.901 . . . . 0.0 110.171 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -77.14 -158.78 0.11 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.249 -0.907 . . . . 0.0 110.339 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ttp -89.7 -28.85 19.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.276 -0.89 . . . . 0.0 110.116 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.54 157.09 22.48 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.271 -0.893 . . . . 0.0 110.252 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.78 83.56 2.18 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.234 -0.916 . . . . 0.0 110.2 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.0 p -119.41 68.77 0.82 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.298 -0.876 . . . . 0.0 110.208 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.25 -62.84 1.39 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.293 -0.879 . . . . 0.0 110.287 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 tt -148.54 109.76 4.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.25 -0.907 . . . . 0.0 110.367 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -114.69 135.37 54.24 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.237 -0.915 . . . . 0.0 110.224 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -121.64 -76.97 0.58 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.267 -0.896 . . . . 0.0 110.173 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -75.89 117.55 17.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.312 -0.868 . . . . 0.0 110.239 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.483 ' O ' ' C ' ' A' ' 11' ' ' LYS . 11.7 tpt -72.75 -54.03 10.02 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.36 -0.838 . . . . 0.0 110.174 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.512 ' HG3' ' N ' ' A' ' 12' ' ' ASN . 2.4 pttt 33.34 -143.92 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.773 -0.579 . . . . 0.0 111.197 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' A' ' 11' ' ' LYS . 0.9 OUTLIER 59.96 45.9 11.65 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.224 -0.922 . . . . 0.0 109.982 -179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.5 tt -103.13 -175.32 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.255 -0.903 . . . . 0.0 110.167 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.3 m -119.37 141.56 38.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.218 -0.926 . . . . 0.0 110.423 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -104.72 8.98 35.21 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.235 -0.916 . . . . 0.0 110.128 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.82 63.21 1.71 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.317 -0.864 . . . . 0.0 110.163 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -70.17 176.75 3.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.348 -0.845 . . . . 0.0 110.201 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.2 t 50.09 70.2 0.53 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.347 -0.846 . . . . 0.0 110.252 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -132.01 15.64 4.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.251 -0.905 . . . . 0.0 110.188 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.521 ' HB3' ' CD1' ' A' ' 46' ' ' LEU . . . -54.16 -46.12 72.23 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 110.115 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.444 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 3.1 pt-20 -41.87 -46.73 4.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.387 -0.821 . . . . 0.0 110.418 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 63.3 mt -63.13 -44.21 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.223 -0.923 . . . . 0.0 110.023 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.527 ' CG ' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -57.22 -32.74 66.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.289 -0.882 . . . . 0.0 110.103 179.775 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.527 ' CG1' ' HB3' ' A' ' 59' ' ' MET . 28.2 t -71.72 -28.06 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.148 -0.97 . . . . 0.0 110.018 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -45.32 64.04 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.204 -0.935 . . . . 0.0 109.985 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -78.54 -22.53 47.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.328 -0.857 . . . . 0.0 110.022 179.85 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.437 ' N ' HD13 ' A' ' 39' ' ' LEU . . . -77.26 -21.98 52.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.294 -0.879 . . . . 0.0 110.218 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.452 HG21 ' HA ' ' A' ' 77' ' ' ALA . 25.2 p -92.93 39.63 1.04 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.225 -0.922 . . . . 0.0 110.199 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -172.97 -165.46 0.3 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.249 -0.907 . . . . 0.0 110.213 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.411 ' ND2' ' N ' ' A' ' 30' ' ' ASN . 1.5 p30 -165.73 166.69 17.69 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.219 -0.925 . . . . 0.0 110.194 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -125.72 158.71 64.24 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 121.271 -0.893 . . . . 0.0 110.246 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.413 ' O ' ' HB2' ' A' ' 33' ' ' TRP . 20.0 Cg_endo -66.68 -173.95 0.42 Allowed 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.037 1.546 . . . . 0.0 110.391 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.413 ' HB2' ' O ' ' A' ' 32' ' ' PRO . 6.1 m95 60.19 -92.89 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.274 -0.891 . . . . 0.0 110.529 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -129.36 93.58 0.34 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -65.42 122.02 9.6 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.022 1.538 . . . . 0.0 110.337 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.4 130.65 47.11 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.175 -0.953 . . . . 0.0 110.18 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.2 t -124.98 83.87 2.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.258 -0.901 . . . . 0.0 110.203 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.8 t -172.76 54.15 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.33 -0.856 . . . . 0.0 110.239 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.527 HD22 ' CG ' ' A' ' 23' ' ' LYS . 0.8 OUTLIER -127.53 -4.14 6.0 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.257 -0.902 . . . . 0.0 110.137 179.998 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.564 ' HG2' ' CG ' ' A' ' 83' ' ' TYR . 0.2 OUTLIER -77.97 -56.52 4.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.235 -0.915 . . . . 0.0 110.182 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.7 t -62.73 -29.89 71.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.271 -0.893 . . . . 0.0 110.386 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.47 -60.46 2.3 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.168 -0.957 . . . . 0.0 110.467 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.486 HG22 HD13 ' A' ' 43' ' ' ILE . 15.8 mt -50.39 -31.65 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.222 -0.924 . . . . 0.0 110.301 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.561 ' HB1' HD22 ' A' ' 84' ' ' LEU . . . -70.66 -51.31 28.69 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.071 -1.018 . . . . 0.0 109.418 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.468 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.5 OUTLIER -53.96 -20.6 6.43 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.102 -0.999 . . . . 0.0 108.892 178.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.521 ' CD1' ' HB3' ' A' ' 20' ' ' ALA . 20.4 mt -81.13 -37.02 29.54 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.535 -0.728 . . . . 0.0 109.954 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.549 HG22 HG21 ' A' ' 92' ' ' VAL . 80.7 p -53.04 -42.87 66.14 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.099 -1.001 . . . . 0.0 109.099 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.468 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 93.1 m-85 -44.37 -42.22 6.71 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.267 -0.896 . . . . 0.0 109.511 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.532 ' O ' ' N ' ' A' ' 51' ' ' VAL . 5.3 m-80 -73.19 92.64 1.76 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.483 -0.761 . . . . 0.0 110.187 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.526 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.39 -57.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.657 178.343 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.565 HG13 ' N ' ' A' ' 52' ' ' ALA . 3.0 t -65.82 -66.38 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.963 -1.086 . . . . 0.0 110.482 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.565 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -36.01 -45.31 0.42 Allowed 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.161 0.505 . . . . 0.0 111.08 -177.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.586 ' CE1' HG23 ' A' ' 92' ' ' VAL . 6.0 t80 -55.68 -58.85 6.08 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.307 -0.871 . . . . 0.0 110.393 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.458 ' O ' ' HB2' ' A' ' 58' ' ' SER . 18.2 m -51.1 -42.03 60.38 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.165 -0.959 . . . . 0.0 110.44 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.444 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 1.5 mm-40 -66.33 -30.96 71.48 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.198 -0.939 . . . . 0.0 110.505 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.518 HG21 HD13 ' A' ' 84' ' ' LEU . 7.1 mt -74.23 -70.01 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.334 -0.854 . . . . 0.0 110.359 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.424 ' HE1' ' CZ2' ' A' ' 61' ' ' TRP . 52.6 mmm -46.7 -38.27 9.62 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.131 -0.981 . . . . 0.0 110.128 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.458 ' HB2' ' O ' ' A' ' 54' ' ' SER . 23.2 t -52.7 -60.68 2.96 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.252 -0.905 . . . . 0.0 110.26 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.527 ' HB3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -58.23 -31.47 67.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.142 -0.974 . . . . 0.0 109.858 179.793 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.561 HG22 HD13 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -66.92 -29.59 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.411 -0.806 . . . . 0.0 109.917 179.883 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.572 ' CZ3' ' HE2' ' A' ' 81' ' ' MET . 19.7 m95 -79.39 -41.67 27.22 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.247 -0.908 . . . . 0.0 110.434 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.53 -66.3 0.46 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.249 -0.907 . . . . 0.0 110.636 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.521 ' CZ ' ' HB3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -61.37 -23.9 66.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.916 . . . . 0.0 110.606 -179.602 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.704 HD21 HD11 ' A' ' 106' ' ' LEU . 3.8 mt -60.78 -27.34 67.92 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.151 -0.968 . . . . 0.0 110.337 -179.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.407 ' O ' ' C ' ' A' ' 66' ' ' ASP . 11.5 t30 -103.48 37.3 2.04 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.286 -0.883 . . . . 0.0 110.014 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.407 ' C ' ' O ' ' A' ' 65' ' ' ASN . 0.4 OUTLIER -41.97 156.59 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.423 -0.798 . . . . 0.0 110.286 -179.888 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.73 -171.55 0.07 Allowed 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.636 -0.665 . . . . 0.0 110.128 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -93.68 58.07 2.22 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.1 ttpp -137.18 -37.31 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.165 -1.197 . . . . 0.0 110.368 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -151.72 107.91 3.42 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.3 -0.875 . . . . 0.0 110.414 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 33.1 p-90 -78.29 -5.53 52.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.294 -0.879 . . . . 0.0 110.272 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -45.92 -46.76 16.24 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.298 -0.876 . . . . 0.0 110.285 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -59.81 -40.01 86.98 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.234 -0.916 . . . . 0.0 110.258 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.545 HG11 ' CG1' ' A' ' 123' ' ' VAL . 49.6 t -62.02 -57.32 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.172 -0.955 . . . . 0.0 110.272 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 74' ' ' VAL . 4.6 t80 -42.38 -54.54 3.76 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.299 -0.875 . . . . 0.0 110.315 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -36.69 80.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.19 -0.944 . . . . 0.0 110.263 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.535 ' HB3' HD23 ' A' ' 64' ' ' LEU . . . -62.41 -25.87 68.18 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.235 -0.916 . . . . 0.0 110.159 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.531 ' HE2' ' CG1' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -78.57 -35.32 46.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.198 -0.939 . . . . 0.0 110.177 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 25.6 m -60.26 -55.26 35.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 0.0 109.997 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.531 ' CD2' HD13 ' A' ' 60' ' ' ILE . 25.5 tp -59.91 -34.63 73.46 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.456 -0.778 . . . . 0.0 109.964 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.572 ' HE2' ' CZ3' ' A' ' 61' ' ' TRP . 15.9 ttm -66.39 -33.74 76.4 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.137 -0.977 . . . . 0.0 110.122 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.526 ' HB2' ' CD1' ' A' ' 130' ' ' LEU . 3.7 tp10 -77.74 -63.83 1.29 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.295 -0.878 . . . . 0.0 110.144 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.564 ' CG ' ' HG2' ' A' ' 40' ' ' MET . 54.0 t80 -41.27 -49.65 3.66 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.418 -0.801 . . . . 0.0 110.641 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.561 HD22 ' HB1' ' A' ' 44' ' ' ALA . 81.6 mt -64.72 -43.78 92.32 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.311 -0.868 . . . . 0.0 110.337 -179.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.526 HG21 HD12 ' A' ' 134' ' ' LEU . 13.5 mt -49.69 -25.98 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.086 -1.009 . . . . 0.0 109.768 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.8 mttp -97.18 -81.36 0.43 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 110.053 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.556 HG21 ' CE1' ' A' ' 83' ' ' TYR . 13.0 t -72.64 -24.67 61.08 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.301 -0.874 . . . . 0.0 110.271 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.497 ' N ' HG23 ' A' ' 87' ' ' THR . . . -47.22 -77.23 0.11 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.435 ' HB3' HG22 ' A' ' 92' ' ' VAL . 26.7 t -179.17 155.98 0.75 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.159 -1.2 . . . . 0.0 110.326 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -56.91 -17.79 10.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.288 -0.882 . . . . 0.0 110.177 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -83.25 -37.07 24.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.323 -0.86 . . . . 0.0 110.175 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.586 HG23 ' CE1' ' A' ' 53' ' ' PHE . 59.2 t -59.92 -32.14 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.292 -0.88 . . . . 0.0 110.085 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.0 t -79.01 -40.75 30.63 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.0 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.527 ' O ' ' CG ' ' A' ' 97' ' ' LYS . 38.9 mt-30 -65.58 -26.14 67.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 109.867 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.41 ' HG2' ' HE2' ' A' ' 57' ' ' MET . 0.0 OUTLIER -75.41 -35.91 60.91 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.244 -0.91 . . . . 0.0 109.519 179.588 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.461 ' SG ' ' CD1' ' A' ' 85' ' ' ILE . 1.3 m -65.61 -37.9 87.92 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.33 -0.856 . . . . 0.0 109.669 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.527 ' CG ' ' O ' ' A' ' 94' ' ' GLN . 0.2 OUTLIER -72.8 -28.14 62.4 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.339 -0.851 . . . . 0.0 109.596 179.349 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.496 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 7.7 mm-40 -75.32 -29.99 60.17 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.368 -0.832 . . . . 0.0 109.348 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -116.66 44.38 2.04 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.502 -0.749 . . . . 0.0 109.583 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -29.27 69.78 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.431 -0.793 . . . . 0.0 110.259 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.473 ' O ' ' HB ' ' A' ' 105' ' ' THR . 57.9 m-85 -66.44 -24.92 66.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.205 -0.934 . . . . 0.0 109.779 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.524 ' O ' ' CG2' ' A' ' 105' ' ' THR . . . -77.47 -41.32 39.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.462 -0.774 . . . . 0.0 110.112 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.425 HG21 ' CZ3' ' A' ' 61' ' ' TRP . 4.0 t -72.33 -31.01 37.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.356 -0.84 . . . . 0.0 110.156 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.497 ' O ' ' CG ' ' A' ' 107' ' ' LYS . 7.5 mm-40 -86.91 -19.41 28.89 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 110.426 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.524 ' CG2' ' O ' ' A' ' 102' ' ' ALA . 6.6 t -54.7 -18.9 5.17 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.931 . . . . 0.0 109.927 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.704 HD11 HD21 ' A' ' 64' ' ' LEU . 91.3 mt -79.41 -35.65 40.31 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.389 -0.819 . . . . 0.0 110.118 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.533 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -52.54 -18.98 1.97 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.263 -0.898 . . . . 0.0 110.32 179.937 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.447 ' OD1' ' HD2' ' A' ' 107' ' ' LYS . 49.4 m-20 -103.06 -28.96 11.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.209 -0.932 . . . . 0.0 110.463 -179.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.415 ' C ' ' O ' ' A' ' 108' ' ' ASP . 0.1 OUTLIER -43.72 105.47 0.05 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.142 -0.974 . . . . 0.0 110.269 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -145.54 125.94 14.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.316 -0.865 . . . . 0.0 110.164 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.412 ' O ' HG21 ' A' ' 112' ' ' VAL . 0.1 OUTLIER -133.37 110.23 9.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.223 -0.923 . . . . 0.0 110.143 179.98 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.45 HG22 ' HA ' ' A' ' 118' ' ' ASP . 22.5 t -140.38 46.63 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.225 -0.922 . . . . 0.0 110.495 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -93.77 -83.63 0.32 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.19 -0.944 . . . . 0.0 110.102 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.448 ' HD2' ' OD1' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -54.98 -47.55 74.44 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.234 -0.916 . . . . 0.0 110.486 179.944 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.448 ' OD1' ' HD2' ' A' ' 114' ' ' ARG . 59.3 m-20 -68.86 -91.02 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.991 . . . . 0.0 110.324 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.449 ' O ' ' O ' ' A' ' 117' ' ' LYS . . . 134.94 157.2 7.96 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.449 ' O ' ' O ' ' A' ' 116' ' ' GLY . 0.2 OUTLIER 60.78 132.08 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.276 -1.132 . . . . 0.0 110.214 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.45 ' HA ' HG22 ' A' ' 112' ' ' VAL . 26.5 t0 -80.51 128.07 33.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.266 -0.896 . . . . 0.0 110.221 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.455 ' CG ' ' N ' ' A' ' 120' ' ' GLY . 18.8 pt20 -127.59 -36.79 2.03 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.215 -0.928 . . . . 0.0 110.27 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.455 ' N ' ' CG ' ' A' ' 119' ' ' GLN . . . -63.66 91.3 0.09 OUTLIER Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.558 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.3 p -129.43 -42.93 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 O-C-N 121.254 -1.145 . . . . 0.0 110.148 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . 0.558 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 6.0 t30 -39.19 -31.77 0.08 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.66 -0.65 . . . . 0.0 110.361 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.545 ' CG1' HG11 ' A' ' 74' ' ' VAL . 2.3 t -83.49 -52.62 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.304 -0.872 . . . . 0.0 109.93 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.533 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 4.4 mtp180 -44.79 -43.67 8.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.142 -0.974 . . . . 0.0 111.176 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -79.33 -46.15 18.25 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.195 -0.94 . . . . 0.0 111.769 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . 0.522 ' CD ' ' HB2' ' A' ' 78' ' ' MET . 0.0 OUTLIER -53.66 -54.92 30.88 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.919 -1.113 . . . . 0.0 110.109 -179.511 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.488 ' CB ' ' SD ' ' A' ' 78' ' ' MET . . . -55.46 -44.22 76.21 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.437 -0.789 . . . . 0.0 110.396 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -58.85 -34.66 71.83 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.168 -0.958 . . . . 0.0 110.5 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -69.41 -53.54 18.85 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.227 -0.921 . . . . 0.0 110.78 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.526 ' CD1' ' HB2' ' A' ' 82' ' ' GLU . 3.3 tt -47.35 -33.66 6.06 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.09 -1.006 . . . . 0.0 110.416 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.455 HG21 ' O ' ' A' ' 127' ' ' ALA . 44.8 t -77.26 -35.38 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.252 -0.905 . . . . 0.0 110.333 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.19 -49.53 75.7 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -0.91 . . . . 0.0 110.694 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.1 mt -60.93 -56.83 16.52 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.157 -0.965 . . . . 0.0 110.467 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.526 HD12 HG21 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -52.53 -21.96 4.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.18 -0.95 . . . . 0.0 110.284 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 29.1 ttt85 -132.12 82.76 2.04 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.332 -0.855 . . . . 0.0 110.264 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -147.16 -57.62 0.26 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.256 -0.903 . . . . 0.0 110.244 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.91 166.07 24.95 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.234 -0.916 . . . . 0.0 110.309 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -129.98 174.66 9.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.274 -0.891 . . . . 0.0 110.104 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.09 68.12 0.99 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.259 -0.9 . . . . 0.0 110.3 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.7 mt -68.23 171.42 7.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.916 . . . . 0.0 110.056 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -113.99 80.71 1.42 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.238 -0.914 . . . . 0.0 110.194 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -133.31 -62.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.267 -0.895 . . . . 0.0 110.037 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -125.4 -46.94 1.75 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.923 . . . . 0.0 110.206 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.249 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.231 0.539 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.721 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -68.37 -52.31 34.57 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.237 -0.914 . . . . 0.0 110.309 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.438 ' C ' ' O ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -41.05 -34.03 0.39 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.287 -0.883 . . . . 0.0 110.601 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.1 mm -77.88 -41.86 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.095 -1.003 . . . . 0.0 109.964 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.534 ' HE2' ' CG ' ' A' ' 42' ' ' GLU . 13.3 tptt -61.55 -58.65 7.26 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.253 -0.904 . . . . 0.0 109.934 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.868 HG21 ' HA ' ' A' ' 56' ' ' ILE . 53.7 t -45.45 -55.11 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.407 -0.808 . . . . 0.0 110.385 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.405 ' HG3' ' NH2' ' A' ' 63' ' ' ARG . 18.8 ttt180 -52.69 -63.36 1.17 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.913 . . . . 0.0 110.653 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -14.05 5.44 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.401 -0.812 . . . . 0.0 110.714 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.923 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -86.55 -33.44 20.25 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.134 -0.979 . . . . 0.0 110.328 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.519 ' CA ' ' HB3' ' A' ' 76' ' ' LYS . 19.8 p . . . . . 0 N--CA 1.49 1.551 0 O-C-N 121.288 -0.883 . . . . 0.0 110.119 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.923 HD23 ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.314 0.578 . . . . 0.0 110.231 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.405 ' HA ' HD12 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -55.18 -45.02 75.76 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.131 -0.98 . . . . 0.0 110.141 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.405 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 15.6 t -59.72 -29.59 68.22 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.331 -0.855 . . . . 0.0 110.272 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.534 ' CG ' ' HE2' ' A' ' 23' ' ' LYS . 22.0 mm-40 -70.43 -52.06 24.92 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.255 -0.903 . . . . 0.0 110.286 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.774 HD13 ' CD1' ' A' ' 80' ' ' LEU . 7.2 mt -54.24 -35.54 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.183 -0.948 . . . . 0.0 109.992 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.665 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -67.78 -52.21 39.81 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.31 -0.869 . . . . 0.0 109.486 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.485 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 10.8 t0 -53.91 -20.23 5.74 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.087 -1.008 . . . . 0.0 109.187 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.721 HD22 ' HB2' ' A' ' 20' ' ' ALA . 8.5 mt -82.7 -38.11 23.83 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.523 -0.736 . . . . 0.0 110.093 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.532 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 72.3 p -51.82 -42.5 62.56 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.243 -0.911 . . . . 0.0 109.377 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.547 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 86.3 m-85 -43.63 -44.56 6.4 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.712 -0.795 . . . . 0.0 109.259 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.463 ' O ' ' O ' ' A' ' 48' ' ' TYR . 2.4 t-20 -56.68 -157.48 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.865 0.84 . . . . 0.0 110.298 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.6 t -125.97 -34.56 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -178.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.559 HG12 ' N ' ' A' ' 52' ' ' ALA . 11.2 t -84.54 -71.91 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 CA-C-O 121.967 0.889 . . . . 0.0 109.84 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.559 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -37.92 -40.79 0.49 Allowed 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.737 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.653 ' HA ' HD12 ' A' ' 56' ' ' ILE . 8.1 t80 -54.54 -56.4 19.33 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.425 -0.797 . . . . 0.0 110.214 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 58' ' ' SER . 3.5 m -58.87 -34.96 72.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.301 -0.874 . . . . 0.0 110.251 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.65 -20.02 60.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.279 -0.888 . . . . 0.0 110.04 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.868 ' HA ' HG21 ' A' ' 24' ' ' VAL . 36.6 mt -80.96 -70.07 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 110.135 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.5 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 70.5 mmm -52.01 -36.06 48.72 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.25 -0.906 . . . . 0.0 109.909 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 54' ' ' SER . 3.5 m -57.02 -62.69 1.57 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.308 -0.87 . . . . 0.0 110.147 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -25.32 61.06 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 109.894 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.823 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -72.86 -31.34 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.384 -0.823 . . . . 0.0 109.789 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.57 ' CH2' ' SD ' ' A' ' 81' ' ' MET . 14.9 m95 -72.9 -39.84 66.03 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.274 -0.892 . . . . 0.0 110.307 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -58.9 5.81 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.89 . . . . 0.0 110.211 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.405 ' NH2' ' HG3' ' A' ' 25' ' ' ARG . 18.3 mmt180 -63.58 -11.76 27.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.283 -0.885 . . . . 0.0 110.255 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.995 HD22 HD11 ' A' ' 106' ' ' LEU . 4.7 mt -80.17 -24.97 40.0 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.299 -0.876 . . . . 0.0 110.337 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 . . . . . 0 C--N 1.303 -1.428 0 O-C-N 121.352 -0.842 . . . . 0.0 109.949 -179.809 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.474 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 69.3 p-90 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.165 0.507 . . . . 0.0 110.178 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -48.21 -45.53 34.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.206 -0.934 . . . . 0.0 109.985 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.408 ' ND1' ' N ' ' A' ' 73' ' ' HIS . 2.8 m-70 -61.64 -36.57 81.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.311 -0.868 . . . . 0.0 109.924 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.68 HG22 ' O ' ' A' ' 64' ' ' LEU . 16.4 t -63.1 -57.24 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.304 -0.873 . . . . 0.0 110.021 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.585 ' CE1' ' HD3' ' A' ' 126' ' ' LYS . 7.0 t80 -49.2 -49.11 44.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 109.928 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.519 ' HB3' ' CA ' ' A' ' 28' ' ' THR . 4.5 tptt -62.07 -31.85 72.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.339 -0.851 . . . . 0.0 109.843 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.809 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -69.96 -28.02 65.21 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.349 -0.844 . . . . 0.0 109.908 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.562 ' HG2' HD21 ' A' ' 64' ' ' LEU . 0.7 OUTLIER -73.34 -30.83 63.6 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.387 -0.82 . . . . 0.0 110.183 179.862 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.4 m -70.79 -36.66 73.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.214 -0.929 . . . . 0.0 109.97 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.823 ' CD2' HD11 ' A' ' 60' ' ' ILE . 42.0 tp -77.11 -31.4 55.8 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.318 -0.864 . . . . 0.0 109.677 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.57 ' SD ' ' CH2' ' A' ' 61' ' ' TRP . 31.0 ttp -76.71 -28.12 55.74 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.395 -0.815 . . . . 0.0 109.882 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.548 ' HB2' HD11 ' A' ' 130' ' ' LEU . 26.9 tt0 -85.33 -34.97 21.72 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.262 -0.899 . . . . 0.0 110.026 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.405 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 31.8 t80 -70.58 -45.34 65.57 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.309 -0.87 . . . . 0.0 110.257 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.581 HD11 HG21 ' A' ' 43' ' ' ILE . 50.7 mt -67.46 -40.41 85.36 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.274 -0.892 . . . . 0.0 110.16 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.933 HD13 HD11 ' A' ' 134' ' ' LEU . 26.5 mt -56.75 -20.72 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 109.973 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 -82.4 0.41 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.24 -0.913 . . . . 0.0 110.013 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.422 HG23 ' HB1' ' A' ' 44' ' ' ALA . 7.6 t -76.6 -25.9 54.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.293 -0.879 . . . . 0.0 110.149 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.665 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -44.24 -69.58 0.69 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.434 ' HB3' ' HG2' ' A' ' 91' ' ' ARG . 0.1 OUTLIER 176.61 176.16 0.31 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.224 -1.162 . . . . 0.0 110.215 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -79.12 -15.18 58.51 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 110.257 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.451 ' HD3' ' O ' ' A' ' 47' ' ' THR . 2.2 ptm180 -82.84 -28.59 30.02 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.132 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.5 HG21 HG21 ' A' ' 47' ' ' THR . 95.0 t -69.25 -31.18 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.198 -0.938 . . . . 0.0 109.628 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 85' ' ' ILE . 74.5 m -78.81 -35.85 43.58 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.308 -0.87 . . . . 0.0 109.623 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.58 -41.11 98.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.381 -0.824 . . . . 0.0 109.714 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.21 -35.71 81.9 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.442 -0.786 . . . . 0.0 109.489 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.918 ' SG ' HD13 ' A' ' 134' ' ' LEU . 35.2 t -60.14 -39.8 87.6 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.436 -0.79 . . . . 0.0 109.676 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -33.09 69.24 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.437 -0.789 . . . . 0.0 109.776 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -78.15 -17.73 56.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.389 -0.819 . . . . 0.0 109.903 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -124.45 37.97 4.29 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.46 -0.775 . . . . 0.0 109.928 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -60.19 -29.06 68.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.307 -0.871 . . . . 0.0 110.192 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -64.89 -28.06 69.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.274 -0.892 . . . . 0.0 109.899 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.982 ' O ' HG22 ' A' ' 105' ' ' THR . . . -75.68 -42.79 50.21 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.378 -0.826 . . . . 0.0 110.042 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.543 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 3.3 t -71.75 -26.56 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.344 -0.847 . . . . 0.0 110.175 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -85.31 -27.72 25.75 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.329 -0.857 . . . . 0.0 110.311 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.982 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.4 t -56.58 -17.0 7.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.313 -0.867 . . . . 0.0 110.037 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.995 HD11 HD22 ' A' ' 64' ' ' LEU . 17.4 mt -80.12 -40.73 26.87 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.286 -0.884 . . . . 0.0 110.097 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 124' ' ' ARG . 13.6 ttpt . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.217 -0.927 . . . . 0.0 110.077 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.56 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.3 p . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 121.335 0.588 . . . . 0.0 110.169 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.56 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.9 OUTLIER -44.41 -37.17 3.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.367 -0.833 . . . . 0.0 109.9 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.613 ' CG2' HG12 ' A' ' 74' ' ' VAL . 8.5 p -79.75 -38.01 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.509 ' N ' HG13 ' A' ' 123' ' ' VAL . 5.1 ttp180 -54.9 -55.41 30.82 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.242 -0.911 . . . . 0.0 110.394 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -67.94 -28.68 67.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.411 -0.806 . . . . 0.0 110.529 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.585 ' HD3' ' CE1' ' A' ' 75' ' ' TYR . 2.3 tptt -60.51 -58.77 7.09 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.179 -0.951 . . . . 0.0 109.899 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.543 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -54.99 -42.67 72.77 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.395 -0.816 . . . . 0.0 110.099 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.67 -35.34 74.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.244 -0.91 . . . . 0.0 110.165 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -65.13 -52.64 54.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.3 -0.875 . . . . 0.0 110.464 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.97 ' O ' HD12 ' A' ' 134' ' ' LEU . 0.1 OUTLIER -48.54 -39.56 23.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.218 -0.926 . . . . 0.0 110.443 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 11.8 t -77.32 -30.8 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.231 -0.918 . . . . 0.0 110.323 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.25 -56.67 12.98 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.204 -0.935 . . . . 0.0 110.172 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.4 mp -58.96 -53.12 61.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.263 -0.898 . . . . 0.0 110.31 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.97 HD12 ' O ' ' A' ' 130' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.197 -0.939 . . . . 0.0 110.156 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.124 0.487 . . . . 0.0 110.305 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.752 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -79.13 -48.74 13.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -0.884 . . . . 0.0 110.12 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.498 ' CG ' HG13 ' A' ' 22' ' ' ILE . 9.5 pt-20 -47.51 -32.31 5.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.342 -0.849 . . . . 0.0 110.241 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.498 HG13 ' CG ' ' A' ' 21' ' ' GLU . 28.8 mt -80.25 -43.6 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.258 -0.901 . . . . 0.0 110.172 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.615 ' O ' HD11 ' A' ' 43' ' ' ILE . 5.5 mmtm -57.64 -30.46 65.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.256 -0.902 . . . . 0.0 110.193 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.879 HG22 HD21 ' A' ' 80' ' ' LEU . 44.2 t -77.94 -46.92 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.242 -0.911 . . . . 0.0 110.119 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.85 -39.7 26.68 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.336 -0.852 . . . . 0.0 110.102 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -76.29 -37.96 56.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.398 -0.814 . . . . 0.0 110.121 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 1.024 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -65.49 -13.26 58.44 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.322 -0.861 . . . . 0.0 109.964 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.584 ' HA ' ' CB ' ' A' ' 76' ' ' LYS . 8.5 p . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.284 -0.885 . . . . 0.0 110.188 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 1.024 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.189 0.519 . . . . 0.0 110.212 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.1 ttt -71.95 -60.54 2.18 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.29 -0.882 . . . . 0.0 110.18 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.407 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 82.7 p -53.84 -25.27 18.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.254 -0.904 . . . . 0.0 110.064 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -75.54 -53.17 9.05 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 110.114 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.865 HG21 HD11 ' A' ' 80' ' ' LEU . 59.3 mt -54.71 -35.3 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.297 -0.877 . . . . 0.0 110.134 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.659 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -71.75 -49.98 34.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.221 -0.924 . . . . 0.0 109.548 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.424 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 2.9 m-20 -53.29 -21.13 5.03 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.059 -1.025 . . . . 0.0 108.827 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.792 ' HB3' HD11 ' A' ' 56' ' ' ILE . 14.8 mt -79.25 -38.21 36.12 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.621 -0.674 . . . . 0.0 109.852 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.516 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 72.7 p -51.91 -43.76 63.53 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.103 -0.998 . . . . 0.0 109.156 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.43 ' CE2' ' O ' ' A' ' 87' ' ' THR . 87.5 m-85 -44.67 -42.99 7.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.285 -0.884 . . . . 0.0 109.578 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.543 ' O ' ' C ' ' A' ' 50' ' ' VAL . 14.7 m-20 -72.96 90.65 1.49 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.469 -0.77 . . . . 0.0 110.348 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.543 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.2 -59.04 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.25 178.295 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.535 ' H ' HG23 ' A' ' 50' ' ' VAL . 2.6 t -62.98 -64.17 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.09 -1.006 . . . . 0.0 110.1 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.79 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.81 -47.48 1.02 Allowed 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 121.171 0.51 . . . . 0.0 110.846 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.552 ' CZ ' ' OE1' ' A' ' 95' ' ' GLN . 9.7 t80 -56.36 -54.28 47.4 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.292 -0.88 . . . . 0.0 110.289 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.06 -27.59 54.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.219 -0.926 . . . . 0.0 110.196 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -82.92 -25.31 32.54 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.301 -0.874 . . . . 0.0 110.208 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.792 HD11 ' HB3' ' A' ' 46' ' ' LEU . 8.7 mt -79.21 -69.96 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.361 -0.837 . . . . 0.0 109.945 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.535 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 52.0 mmm -45.85 -37.69 6.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.155 -0.966 . . . . 0.0 109.745 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.3 t -55.19 -61.44 2.33 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.347 -0.845 . . . . 0.0 109.893 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.413 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -59.21 -21.45 59.52 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.153 -0.967 . . . . 0.0 109.859 179.689 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.677 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -76.24 -30.77 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.375 -0.828 . . . . 0.0 109.768 179.781 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 57' ' ' MET . 30.2 m95 -77.51 -51.0 11.45 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.891 . . . . 0.0 110.022 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.98 -51.77 49.41 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.241 -0.912 . . . . 0.0 109.969 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -69.01 -24.25 64.19 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.265 -0.897 . . . . 0.0 110.094 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 1.04 HD22 HD11 ' A' ' 106' ' ' LEU . 4.5 mt -71.07 -25.54 62.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.425 -0.797 . . . . 0.0 110.314 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.597 ' O ' ' ND2' ' A' ' 65' ' ' ASN . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.403 0 O-C-N 121.307 -0.871 . . . . 0.0 109.89 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.461 ' CE3' ' HB2' ' A' ' 75' ' ' TYR . 51.7 p-90 . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.16 0.505 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' A' ' 71' ' ' TRP . 42.7 mtt-85 -43.18 -41.92 3.96 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.315 -0.866 . . . . 0.0 110.404 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.1 m-70 -68.0 -43.84 77.97 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.107 -0.996 . . . . 0.0 110.248 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.685 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 70.5 t -56.08 -51.49 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.253 -0.904 . . . . 0.0 110.297 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.497 ' HB2' HG23 ' A' ' 123' ' ' VAL . 6.1 t80 -49.78 -64.56 0.77 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.141 -0.974 . . . . 0.0 109.975 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.584 ' CB ' ' HA ' ' A' ' 28' ' ' THR . 1.1 mmpt? -55.21 -21.7 14.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.327 -0.858 . . . . 0.0 110.044 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.907 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -69.79 -37.97 76.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.182 -0.949 . . . . 0.0 110.186 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.715 ' HE1' HG22 ' A' ' 123' ' ' VAL . 2.8 mpp? -68.39 -41.67 80.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.361 -0.837 . . . . 0.0 110.195 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.6 m -58.41 -45.99 87.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -0.889 . . . . 0.0 110.399 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.879 HD21 HG22 ' A' ' 24' ' ' VAL . 18.2 tp -58.45 -60.27 4.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.268 -0.895 . . . . 0.0 109.926 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.442 ' O ' HG13 ' A' ' 85' ' ' ILE . 28.1 ttm -53.78 -21.97 8.45 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.204 -0.935 . . . . 0.0 110.101 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.447 ' N ' HD11 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -79.89 -37.89 33.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.236 -0.915 . . . . 0.0 110.716 -179.751 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.722 ' O ' HG22 ' A' ' 87' ' ' THR . 32.3 t80 -81.0 -22.66 39.25 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.238 -0.914 . . . . 0.0 110.784 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.728 ' HB2' HG11 ' A' ' 92' ' ' VAL . 48.2 mt -85.17 -21.44 29.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.206 -0.934 . . . . 0.0 110.075 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.998 HG21 HD11 ' A' ' 134' ' ' LEU . 33.2 mt -76.64 -13.98 14.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.316 -0.865 . . . . 0.0 109.553 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -105.39 -48.02 3.8 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.382 -0.824 . . . . 0.0 110.044 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.722 HG22 ' O ' ' A' ' 83' ' ' TYR . 7.6 t -114.48 -2.72 13.12 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.272 -0.892 . . . . 0.0 110.168 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.614 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -89.88 34.88 3.92 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.548 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 2.5 t 74.28 150.14 0.11 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.447 -1.031 . . . . 0.0 110.157 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -65.18 -7.93 14.92 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.354 -0.841 . . . . 0.0 110.598 -179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -72.1 -38.47 69.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.111 -0.993 . . . . 0.0 109.732 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.728 HG11 ' HB2' ' A' ' 84' ' ' LEU . 84.0 t -60.08 -28.92 42.52 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.372 -0.83 . . . . 0.0 109.937 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.517 ' CB ' HG23 ' A' ' 85' ' ' ILE . 10.3 p -83.57 -38.92 21.03 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.283 -0.886 . . . . 0.0 109.982 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -58.03 -57.89 10.83 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.228 -0.92 . . . . 0.0 109.694 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.552 ' OE1' ' CZ ' ' A' ' 53' ' ' PHE . 34.8 tt0 -52.79 -35.7 57.09 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.454 -0.778 . . . . 0.0 109.448 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.416 ' SG ' HD11 ' A' ' 85' ' ' ILE . 1.7 t -55.41 -44.23 76.01 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 109.563 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -66.0 -46.81 76.65 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.497 -0.752 . . . . 0.0 109.747 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -65.01 -16.12 63.08 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.408 -0.807 . . . . 0.0 109.797 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.5 32.81 4.95 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.366 -0.834 . . . . 0.0 109.844 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.1 mtp -61.63 -28.26 69.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.298 -0.876 . . . . 0.0 110.224 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.476 ' O ' ' HB ' ' A' ' 105' ' ' THR . 15.6 m-85 -66.84 -24.97 66.21 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.236 -0.915 . . . . 0.0 109.934 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.951 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.59 -40.88 48.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.885 . . . . 0.0 110.008 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.538 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.9 t -75.06 -27.04 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.351 -0.843 . . . . 0.0 109.903 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.545 ' HG3' HG21 ' A' ' 131' ' ' VAL . 21.2 mt-30 -85.7 -28.24 24.79 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.411 -0.806 . . . . 0.0 109.985 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.4 t -53.44 -24.79 13.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.903 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 1.04 HD11 HD22 ' A' ' 64' ' ' LEU . 42.0 mt -70.53 -38.48 74.25 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.392 -0.818 . . . . 0.0 109.955 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.578 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 14.4 ttpt . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.245 -0.909 . . . . 0.0 109.888 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.555 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.1 p . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 121.335 0.588 . . . . 0.0 110.353 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.555 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.2 m-80 -40.91 -46.94 2.89 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.482 -0.761 . . . . 0.0 110.271 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.715 HG22 ' HE1' ' A' ' 78' ' ' MET . 0.9 OUTLIER -66.33 -42.92 91.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.319 -0.863 . . . . 0.0 109.867 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.578 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -56.87 -67.85 0.27 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.188 -0.945 . . . . 0.0 111.063 -179.554 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.18 -35.95 76.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.284 -0.885 . . . . 0.0 111.331 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 0.0 OUTLIER -57.56 -54.14 50.2 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.111 -0.993 . . . . 0.0 110.446 -179.561 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.538 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -57.25 -40.8 78.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.38 -0.825 . . . . 0.0 110.068 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt -62.5 -33.72 75.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.183 -0.948 . . . . 0.0 110.241 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -62.71 -40.27 96.63 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.287 -0.883 . . . . 0.0 110.586 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.903 HD21 ' CD1' ' A' ' 85' ' ' ILE . 0.6 OUTLIER -62.5 -53.05 60.44 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.248 -0.907 . . . . 0.0 110.569 -179.677 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.545 HG21 ' HG3' ' A' ' 104' ' ' GLN . 25.3 t -65.84 -25.68 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.408 -0.807 . . . . 0.0 110.413 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.92 -55.55 16.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.25 -0.906 . . . . 0.0 110.509 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.85 -56.94 15.17 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.137 -0.977 . . . . 0.0 110.307 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.998 HD11 HG21 ' A' ' 85' ' ' ILE . 3.0 mp . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.23 -0.919 . . . . 0.0 110.136 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 1.002 ' HB2' HD12 ' A' ' 22' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.205 0.526 . . . . 0.0 110.23 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.987 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -64.89 -56.8 11.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 110.216 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' A' ' 20' ' ' ALA . 18.8 pt-20 -42.96 -28.52 0.26 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.255 -0.903 . . . . 0.0 110.039 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 1.002 HD12 ' HB2' ' A' ' 19' ' ' GLU . 40.8 mt -74.19 -57.65 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.314 -0.866 . . . . 0.0 110.037 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.491 ' CB ' HG12 ' A' ' 43' ' ' ILE . 1.8 mmpt? -48.09 -51.05 26.14 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.351 -0.843 . . . . 0.0 110.214 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.943 HG13 ' CD2' ' A' ' 80' ' ' LEU . 20.0 t -56.28 -36.28 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.286 -0.884 . . . . 0.0 110.207 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.4 ttt85 -67.05 -38.14 85.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.2 -0.937 . . . . 0.0 110.177 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -81.18 -14.75 57.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.265 -0.897 . . . . 0.0 109.966 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.811 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -77.72 -20.29 53.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.867 . . . . 0.0 110.244 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.467 HG22 ' HB3' ' A' ' 76' ' ' LYS . 30.2 p . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.226 -0.921 . . . . 0.0 110.251 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.811 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.255 0.55 . . . . 0.0 110.263 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.573 ' CE ' HG22 ' A' ' 79' ' ' THR . 6.9 mmm -84.79 -45.79 12.01 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.186 -0.946 . . . . 0.0 110.207 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.408 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.2 OUTLIER -63.97 -29.34 70.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.355 -0.84 . . . . 0.0 110.277 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -72.77 -49.64 29.55 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.938 . . . . 0.0 110.102 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.799 HG21 HD11 ' A' ' 80' ' ' LEU . 44.7 mt -55.91 -33.87 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.273 -0.892 . . . . 0.0 110.022 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.64 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -71.63 -52.9 15.56 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.236 -0.915 . . . . 0.0 109.401 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.478 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 7.4 t70 -51.82 -22.38 3.63 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.059 -1.025 . . . . 0.0 108.742 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.987 HD22 ' HB2' ' A' ' 20' ' ' ALA . 8.1 mt -78.24 -40.03 38.47 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.611 -0.681 . . . . 0.0 110.017 179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.525 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 73.1 p -49.69 -42.0 44.64 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.11 -0.994 . . . . 0.0 109.159 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.561 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 83.7 m-85 -45.52 -46.27 13.85 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.234 -0.916 . . . . 0.0 109.367 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 50' ' ' VAL . 22.7 m-20 -71.14 89.65 0.85 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.529 -0.732 . . . . 0.0 110.358 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.73 -57.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.561 178.228 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.54 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -63.07 -65.9 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.04 -1.037 . . . . 0.0 110.069 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -38.16 -42.43 0.67 Allowed 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.305 0.574 . . . . 0.0 110.602 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.525 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 10.0 t80 -59.56 -53.65 55.67 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.376 -0.828 . . . . 0.0 109.952 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -30.36 62.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.28 -0.887 . . . . 0.0 109.745 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.68 -25.67 41.18 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.307 -0.871 . . . . 0.0 110.178 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.863 ' HA ' HG21 ' A' ' 24' ' ' VAL . 6.9 mt -77.59 -70.18 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.324 -0.86 . . . . 0.0 110.283 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.497 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 91.6 mmm -47.75 -36.31 11.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.21 -0.931 . . . . 0.0 109.91 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 t -55.21 -60.67 3.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.377 -0.827 . . . . 0.0 109.971 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.27 -25.6 65.83 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -0.953 . . . . 0.0 109.687 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.647 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -71.1 -29.59 37.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.379 -0.825 . . . . 0.0 109.506 179.641 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.477 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 13.4 m95 -78.21 -41.04 35.69 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.239 -0.913 . . . . 0.0 109.964 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.78 -53.03 53.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.329 -0.857 . . . . 0.0 109.964 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.488 ' HB3' ' HB3' ' A' ' 73' ' ' HIS . 4.0 mmt180 -70.06 -33.83 72.43 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.381 -0.824 . . . . 0.0 109.992 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.941 HD22 HD11 ' A' ' 106' ' ' LEU . 11.8 mt -65.11 -9.45 22.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.447 -0.783 . . . . 0.0 110.357 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--N 1.302 -1.473 0 O-C-N 121.307 -0.87 . . . . 0.0 110.156 -179.857 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.455 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 35.7 p-90 . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.209 0.528 . . . . 0.0 110.048 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -52.56 -39.59 61.66 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.392 -0.817 . . . . 0.0 110.287 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.488 ' HB3' ' HB3' ' A' ' 63' ' ' ARG . 5.0 m-70 -61.99 -36.81 82.6 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.207 -0.933 . . . . 0.0 110.111 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.813 HG12 HG22 ' A' ' 123' ' ' VAL . 24.5 t -59.06 -54.54 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.31 -0.869 . . . . 0.0 110.125 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.461 ' HA ' ' HE1' ' A' ' 78' ' ' MET . 22.7 t80 -49.91 -56.45 10.5 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.183 -0.948 . . . . 0.0 109.995 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.467 ' HB3' HG22 ' A' ' 28' ' ' THR . 0.0 OUTLIER -59.74 -25.81 65.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.352 -0.843 . . . . 0.0 110.036 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.793 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -73.12 -27.43 61.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.317 -0.864 . . . . 0.0 110.038 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.643 ' SD ' HD13 ' A' ' 106' ' ' LEU . 1.5 mpp? -74.76 -32.96 62.21 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.327 -0.858 . . . . 0.0 109.991 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.573 HG22 ' CE ' ' A' ' 40' ' ' MET . 35.9 m -74.69 -27.74 60.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.399 -0.813 . . . . 0.0 110.283 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.943 ' CD2' HG13 ' A' ' 24' ' ' VAL . 19.5 tp -76.09 -53.49 8.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.161 -0.962 . . . . 0.0 109.378 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.808 ' HE2' HD11 ' A' ' 64' ' ' LEU . 6.5 ttp -61.39 -20.62 63.24 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.158 -0.964 . . . . 0.0 109.724 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.576 ' CB ' HD13 ' A' ' 130' ' ' LEU . 13.4 tm-20 -88.36 -33.49 17.93 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.167 -0.958 . . . . 0.0 110.354 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.49 ' O ' HG22 ' A' ' 87' ' ' THR . 10.5 t80 -79.87 -21.92 43.48 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.269 -0.894 . . . . 0.0 110.467 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.581 HD13 HG21 ' A' ' 56' ' ' ILE . 68.5 mt -88.86 -34.74 16.89 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.261 -0.899 . . . . 0.0 110.021 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.813 HD12 HD11 ' A' ' 130' ' ' LEU . 37.5 mt -56.95 -22.95 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.061 -1.024 . . . . 0.0 109.972 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -95.24 -80.49 0.41 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.233 -0.917 . . . . 0.0 110.284 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.64 HG23 ' HB1' ' A' ' 44' ' ' ALA . 7.9 t -75.65 -24.44 56.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.254 -0.904 . . . . 0.0 110.319 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.561 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -49.34 -77.29 0.13 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.0 t 177.09 154.16 0.24 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.251 -1.146 . . . . 0.0 110.31 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.47 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 1.6 mt-10 -55.92 -17.19 5.91 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.902 . . . . 0.0 110.303 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -77.02 -38.02 53.81 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.181 -0.949 . . . . 0.0 110.11 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.486 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 73.1 t -59.67 -38.96 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.213 -0.929 . . . . 0.0 110.084 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.91 -40.24 72.28 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.881 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 90' ' ' GLU . 5.6 mt-30 -60.72 -39.77 89.81 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.229 -0.919 . . . . 0.0 109.994 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.441 ' HA ' ' OE1' ' A' ' 95' ' ' GLN . 3.5 tp60 -65.07 -39.59 93.46 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.321 -0.862 . . . . 0.0 109.259 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.814 ' HB3' HD13 ' A' ' 134' ' ' LEU . 2.8 m -56.2 -41.31 75.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.341 -0.849 . . . . 0.0 109.503 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 22.0 mtmt -67.56 -32.46 73.25 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.497 -0.752 . . . . 0.0 109.441 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -80.31 -14.32 58.47 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.411 -0.805 . . . . 0.0 109.68 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -129.86 33.4 4.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.452 -0.78 . . . . 0.0 110.08 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' MET . . . . . 0.459 ' HE3' ' CZ ' ' A' ' 101' ' ' TYR . 8.4 ptt? -60.74 -28.94 69.07 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.247 -0.908 . . . . 0.0 110.252 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.459 ' CZ ' ' HE3' ' A' ' 100' ' ' MET . 41.5 m-85 -65.61 -26.4 67.81 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.337 -0.852 . . . . 0.0 110.198 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.969 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.65 -41.4 45.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 110.133 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.429 HG23 ' H ' ' A' ' 103' ' ' VAL . 2.5 t -73.2 -25.85 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.324 -0.86 . . . . 0.0 109.989 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -87.65 -24.82 23.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.287 -0.883 . . . . 0.0 110.452 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.969 HG22 ' O ' ' A' ' 102' ' ' ALA . 12.0 t -63.59 -12.61 34.57 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.186 -0.946 . . . . 0.0 110.368 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.941 HD11 HD22 ' A' ' 64' ' ' LEU . 17.4 mt -73.86 -40.05 63.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.189 -0.944 . . . . 0.0 110.219 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.161 -0.962 . . . . 0.0 110.025 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.561 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.9 p . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 121.332 0.587 . . . . 0.0 110.26 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.561 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 2.6 t30 -40.56 -27.68 0.05 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.595 -0.69 . . . . 0.0 110.257 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.813 HG22 HG12 ' A' ' 74' ' ' VAL . 2.0 t -76.74 -49.23 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.245 -0.909 . . . . 0.0 109.968 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -60.34 -36.8 78.81 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.116 -0.99 . . . . 0.0 110.802 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -77.93 -61.41 2.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.183 -0.948 . . . . 0.0 110.88 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -48.65 -44.52 37.62 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.151 -0.968 . . . . 0.0 110.268 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.504 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -65.38 -44.14 88.49 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.298 -0.876 . . . . 0.0 110.411 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -49.79 -39.13 37.12 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.186 -0.946 . . . . 0.0 110.505 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -71.31 -50.95 27.31 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.221 -0.924 . . . . 0.0 110.438 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.813 HD11 HD12 ' A' ' 85' ' ' ILE . 11.9 tp -49.48 -22.31 1.17 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.247 -0.908 . . . . 0.0 110.317 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 127' ' ' ALA . 42.8 t -92.19 -31.76 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 110.304 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.408 ' O ' ' C ' ' A' ' 133' ' ' LEU . . . -70.37 -63.13 1.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.318 -0.864 . . . . 0.0 110.302 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.408 ' C ' ' O ' ' A' ' 132' ' ' ALA . 13.2 tp -43.53 -27.42 0.29 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.228 -0.92 . . . . 0.0 110.351 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.814 HD13 ' HB3' ' A' ' 96' ' ' CYS . 20.5 mt . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.914 . . . . 0.0 110.335 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.451 ' O ' ' HB ' ' A' ' 22' ' ' ILE . 4.5 mt-10 . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.093 0.473 . . . . 0.0 110.344 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.851 ' HB2' HD13 ' A' ' 46' ' ' LEU . . . -57.19 -50.45 72.8 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.918 . . . . 0.0 110.095 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 1.2 pt-20 -48.52 -28.06 3.12 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.203 -0.936 . . . . 0.0 109.897 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.451 ' HB ' ' O ' ' A' ' 19' ' ' GLU . 49.3 mm -73.29 -41.47 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.295 -0.878 . . . . 0.0 109.904 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.473 ' CB ' HG12 ' A' ' 43' ' ' ILE . 11.6 mmtt -64.56 -42.75 95.47 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.253 -0.904 . . . . 0.0 109.907 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 1.036 HG22 HD21 ' A' ' 80' ' ' LEU . 14.8 t -64.81 -30.65 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.264 -0.897 . . . . 0.0 110.03 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -62.34 -42.69 99.59 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.201 -0.937 . . . . 0.0 110.04 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -83.44 -19.88 35.12 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.48 -0.763 . . . . 0.0 110.108 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.872 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -81.25 -14.16 57.74 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.307 -0.87 . . . . 0.0 110.25 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.492 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 3.8 p . . . . . 0 N--CA 1.491 1.623 0 O-C-N 121.24 -0.912 . . . . 0.0 110.292 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.872 HD21 ' HB2' ' A' ' 27' ' ' ALA . 1.9 tp . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.177 0.513 . . . . 0.0 110.369 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -44.45 77.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.266 -0.896 . . . . 0.0 110.497 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.411 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.1 OUTLIER -66.5 -28.25 68.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.171 -0.956 . . . . 0.0 110.589 -179.767 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.68 -47.73 44.97 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.203 -0.936 . . . . 0.0 110.257 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.648 HG23 HG12 ' A' ' 56' ' ' ILE . 62.6 mt -57.25 -36.09 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.177 -0.952 . . . . 0.0 110.029 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.725 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.33 -49.84 45.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.174 -0.954 . . . . 0.0 109.522 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -51.25 -22.27 2.61 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.029 -1.044 . . . . 0.0 108.831 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.851 HD13 ' HB2' ' A' ' 20' ' ' ALA . 12.4 mt -81.99 -37.99 25.79 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.623 -0.673 . . . . 0.0 110.245 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.573 HG21 HG21 ' A' ' 92' ' ' VAL . 71.8 p -50.51 -40.53 51.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.111 -0.993 . . . . 0.0 109.474 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 49' ' ' ASN . 66.9 m-85 -44.61 -46.75 10.23 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 119.624 -0.83 . . . . 0.0 109.122 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.473 ' O ' ' O ' ' A' ' 48' ' ' TYR . 0.8 OUTLIER -55.62 -158.76 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 CA-C-O 121.98 0.895 . . . . 0.0 110.498 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.428 ' CG2' ' N ' ' A' ' 51' ' ' VAL . 3.1 m -125.5 -34.67 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -178.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.541 HG12 ' N ' ' A' ' 52' ' ' ALA . 8.5 t -82.88 -70.64 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 CA-C-O 122.07 0.938 . . . . 0.0 109.618 178.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.665 ' HB1' ' HB2' ' A' ' 20' ' ' ALA . . . -40.37 -41.58 1.4 Allowed 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.247 -178.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.543 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 12.6 t80 -56.2 -52.6 63.84 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.471 -0.768 . . . . 0.0 109.861 179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 58' ' ' SER . 40.9 t -60.49 -26.86 67.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.316 -0.865 . . . . 0.0 109.643 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 1.7 mm-40 -81.45 -21.56 38.74 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.47 -0.769 . . . . 0.0 109.782 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.648 HG12 HG23 ' A' ' 43' ' ' ILE . 7.7 mt -81.78 -70.12 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.328 -0.857 . . . . 0.0 109.851 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.418 ' HA ' ' HB ' ' A' ' 60' ' ' ILE . 79.8 mmm -49.73 -36.68 26.42 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.31 -0.869 . . . . 0.0 109.73 179.438 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 54' ' ' SER . 2.2 m -55.83 -60.41 3.5 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.316 -0.865 . . . . 0.0 109.696 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.406 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.5 OUTLIER -59.38 -23.84 62.93 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.253 -0.904 . . . . 0.0 109.674 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.547 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -71.64 -33.14 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.427 -0.796 . . . . 0.0 109.569 179.776 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.422 ' CH2' ' CE ' ' A' ' 81' ' ' MET . 28.2 m95 -77.91 -31.35 51.12 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.212 -0.93 . . . . 0.0 109.998 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.93 -57.51 7.69 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.271 -0.893 . . . . 0.0 110.108 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.403 ' NH1' ' CE1' ' A' ' 73' ' ' HIS . 13.7 mmt180 -66.42 -9.89 38.43 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.191 -0.943 . . . . 0.0 109.906 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.984 HD22 HD11 ' A' ' 106' ' ' LEU . 6.2 mt -84.83 -17.65 37.4 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.343 -0.848 . . . . 0.0 110.325 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.0 m-20 . . . . . 0 C--N 1.302 -1.458 0 O-C-N 121.238 -0.914 . . . . 0.0 109.904 -179.738 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.415 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 70.0 p-90 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.261 0.553 . . . . 0.0 110.142 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 13.2 mtp180 -52.63 -41.89 64.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.22 -0.925 . . . . 0.0 110.234 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.403 ' CE1' ' NH1' ' A' ' 63' ' ' ARG . 10.0 m170 -60.62 -41.59 95.17 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.192 -0.943 . . . . 0.0 110.085 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.629 HG11 ' CG1' ' A' ' 123' ' ' VAL . 24.7 t -56.05 -50.8 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.289 -0.882 . . . . 0.0 110.022 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.558 ' CE1' ' O ' ' A' ' 122' ' ' ASN . 7.4 t80 -49.47 -56.7 8.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.207 -0.933 . . . . 0.0 110.226 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -59.19 -26.93 65.24 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.196 -0.94 . . . . 0.0 109.951 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.776 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -70.15 -28.68 65.54 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 110.182 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.694 ' SD ' HD21 ' A' ' 64' ' ' LEU . 1.6 mpp? -76.43 -32.08 58.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.405 -0.809 . . . . 0.0 110.229 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 9.9 m -66.9 -40.18 87.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.082 -1.011 . . . . 0.0 110.122 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 1.036 HD21 HG22 ' A' ' 24' ' ' VAL . 16.2 tp -64.94 -54.14 35.42 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.333 -0.854 . . . . 0.0 109.783 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.529 ' HE2' HG22 ' A' ' 103' ' ' VAL . 0.2 OUTLIER -59.19 -25.27 63.81 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.868 . . . . 0.0 109.887 179.561 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.579 ' HB2' HD12 ' A' ' 130' ' ' LEU . 0.9 OUTLIER -78.46 -34.13 47.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.252 -0.905 . . . . 0.0 110.385 179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.578 ' O ' HG22 ' A' ' 87' ' ' THR . 26.0 t80 -85.6 -16.61 38.72 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.262 -0.899 . . . . 0.0 110.714 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.725 HD23 ' HB2' ' A' ' 44' ' ' ALA . 85.1 mt -92.54 -38.98 11.62 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.166 -0.959 . . . . 0.0 110.232 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.856 HD13 HD11 ' A' ' 134' ' ' LEU . 52.0 mt -57.1 -17.19 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.115 -0.991 . . . . 0.0 109.807 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.58 -80.54 0.47 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.294 -0.879 . . . . 0.0 110.191 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.578 HG22 ' O ' ' A' ' 83' ' ' TYR . 15.0 t -77.72 -18.77 56.22 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.201 -0.937 . . . . 0.0 110.142 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.479 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -55.99 -74.35 0.33 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.212 -1.555 . . . . 0.0 109.212 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 174.47 152.43 0.11 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -1.12 . . . . 0.0 110.337 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -51.98 -24.43 6.53 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 110.109 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.517 ' O ' ' HG2' ' A' ' 94' ' ' GLN . 40.4 mtt180 -70.26 -44.23 68.88 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.304 -0.873 . . . . 0.0 109.722 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 47' ' ' THR . 39.7 t -59.04 -22.16 21.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 120.874 -1.141 . . . . 0.0 108.995 179.21 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.703 ' HB2' HG23 ' A' ' 85' ' ' ILE . 1.9 t -95.18 -19.2 20.26 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.585 -0.697 . . . . 0.0 110.49 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.598 ' CG ' ' N ' ' A' ' 95' ' ' GLN . 7.2 pt20 -79.53 -48.2 14.26 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.93 -1.106 . . . . 0.0 109.104 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.598 ' N ' ' CG ' ' A' ' 94' ' ' GLN . 8.5 tt0 -63.12 -36.45 83.65 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 36.4 t -59.77 -36.27 76.32 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.344 -0.848 . . . . 0.0 109.403 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.18 -35.53 66.41 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.417 -0.802 . . . . 0.0 109.466 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -74.46 -18.29 60.65 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.481 -0.762 . . . . 0.0 109.652 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -121.97 36.8 4.53 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.511 -0.743 . . . . 0.0 109.988 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' MET . . . . . 0.845 ' SD ' HG13 ' A' ' 131' ' ' VAL . 2.0 tpp -59.57 -30.19 68.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.196 -0.94 . . . . 0.0 110.032 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.462 ' O ' ' HB ' ' A' ' 105' ' ' THR . 17.5 m-85 -62.03 -30.04 70.69 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.287 -0.883 . . . . 0.0 109.878 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.957 ' O ' HG22 ' A' ' 105' ' ' THR . . . -70.34 -40.18 74.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.341 -0.849 . . . . 0.0 110.13 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.529 HG22 ' HE2' ' A' ' 81' ' ' MET . 4.6 t -74.86 -27.84 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.354 -0.841 . . . . 0.0 110.332 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.513 ' O ' ' CG ' ' A' ' 107' ' ' LYS . 2.0 mm100 -88.63 -19.51 26.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.314 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.957 HG22 ' O ' ' A' ' 102' ' ' ALA . 11.0 t -67.14 -14.73 63.18 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.17 -0.956 . . . . 0.0 109.985 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.984 HD11 HD22 ' A' ' 64' ' ' LEU . 56.6 mt -77.01 -37.82 54.29 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.348 -0.845 . . . . 0.0 110.169 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.542 ' HA ' ' CB ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.276 -0.89 . . . . 0.0 110.085 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.609 HG22 ' HG3' ' A' ' 125' ' ' GLU . 3.4 p . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 121.214 0.53 . . . . 0.0 110.213 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.558 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 20.7 m-20 -37.16 -28.77 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.8 -0.562 . . . . 0.0 110.788 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.629 ' CG1' HG11 ' A' ' 74' ' ' VAL . 20.4 t -86.25 -63.06 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.247 -0.908 . . . . 0.0 110.303 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.542 ' CB ' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -41.96 -34.01 0.63 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.154 -0.966 . . . . 0.0 110.935 -179.578 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.609 ' HG3' HG22 ' A' ' 121' ' ' VAL . 3.2 mt-10 -82.18 -54.57 5.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.084 -1.01 . . . . 0.0 111.311 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.535 ' HB3' ' HE2' ' A' ' 78' ' ' MET . 0.0 OUTLIER -50.72 -50.14 56.07 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.969 -1.082 . . . . 0.0 110.338 -179.395 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.463 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -61.22 -42.87 99.36 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.38 -0.825 . . . . 0.0 110.408 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -55.51 -56.52 19.28 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.248 -0.907 . . . . 0.0 110.416 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -44.2 65.4 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.265 -0.897 . . . . 0.0 110.494 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.579 HD12 ' HB2' ' A' ' 82' ' ' GLU . 1.1 tt -56.04 -40.89 74.15 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.115 -0.991 . . . . 0.0 110.134 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.845 HG13 ' SD ' ' A' ' 100' ' ' MET . 38.6 t -68.13 -24.8 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.369 -0.832 . . . . 0.0 110.031 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -75.81 -51.66 12.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.351 -0.843 . . . . 0.0 110.385 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -35.13 21.52 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 0.0 110.667 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.856 HD11 HD13 ' A' ' 85' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.425 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.062 0.458 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.68 ' HB2' HD13 ' A' ' 46' ' ' LEU . . . -65.93 -46.14 79.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.178 -0.951 . . . . 0.0 110.067 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.488 ' HG3' HG13 ' A' ' 22' ' ' ILE . 12.8 pt-20 -51.97 -28.81 18.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.158 -0.964 . . . . 0.0 110.014 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.488 HG13 ' HG3' ' A' ' 21' ' ' GLU . 64.4 mt -79.34 -47.32 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.292 -0.88 . . . . 0.0 109.992 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.573 ' O ' HD11 ' A' ' 43' ' ' ILE . 1.8 ttmt -57.91 -30.13 65.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.313 -0.867 . . . . 0.0 110.112 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.792 HG22 HD21 ' A' ' 80' ' ' LEU . 42.4 t -78.96 -41.71 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 109.949 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.506 ' HG2' ' NH1' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -55.59 -42.75 75.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.293 -0.88 . . . . 0.0 109.971 179.88 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -76.21 -30.48 58.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.332 -0.855 . . . . 0.0 110.048 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.768 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -66.05 -16.03 63.57 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.26 -0.9 . . . . 0.0 110.014 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.555 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 80.7 p . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.242 -0.911 . . . . 0.0 110.137 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.768 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.24 0.543 . . . . 0.0 110.224 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -58.01 4.0 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.223 -0.923 . . . . 0.0 110.15 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -44.64 -35.19 2.49 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.321 -0.862 . . . . 0.0 110.168 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.508 ' HB3' ' HD3' ' A' ' 23' ' ' LYS . 29.5 mt-10 -68.4 -56.75 7.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 110.11 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.682 HG21 HD11 ' A' ' 80' ' ' LEU . 5.8 mt -48.64 -35.01 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.0 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.647 ' HA ' HD22 ' A' ' 84' ' ' LEU . . . -69.75 -51.7 31.79 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.204 -0.935 . . . . 0.0 109.776 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.424 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 7.0 m-20 -51.59 -21.74 2.79 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.045 -1.034 . . . . 0.0 109.114 179.125 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.68 HD13 ' HB2' ' A' ' 20' ' ' ALA . 21.4 mt -81.35 -38.48 26.58 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.557 -0.715 . . . . 0.0 110.168 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.559 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 77.3 p -51.07 -42.39 60.54 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.201 -0.937 . . . . 0.0 109.453 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.514 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 74.9 m-85 -43.82 -45.74 7.5 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.732 -0.787 . . . . 0.0 109.191 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.456 ' O ' ' O ' ' A' ' 48' ' ' TYR . 2.1 t-20 -56.61 -159.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.816 0.817 . . . . 0.0 110.32 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.1 t -124.76 -32.9 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-O 121.52 0.676 . . . . 0.0 109.4 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.561 HG12 ' N ' ' A' ' 52' ' ' ALA . 13.1 t -84.6 -72.72 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 CA-C-O 122.059 0.933 . . . . 0.0 109.816 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.561 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -39.14 -41.02 0.78 Allowed 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.482 -178.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.559 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 27.3 t80 -55.56 -53.78 52.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.467 -0.771 . . . . 0.0 109.839 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.72 -27.22 67.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.284 -0.885 . . . . 0.0 109.985 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -82.98 -19.39 37.17 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.286 -0.884 . . . . 0.0 110.018 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.682 ' HA ' HG21 ' A' ' 24' ' ' VAL . 11.2 mt -82.09 -68.8 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.694 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.519 ' SD ' HG13 ' A' ' 92' ' ' VAL . 94.3 mmm -47.27 -34.82 7.03 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.297 -0.877 . . . . 0.0 109.484 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.09 -62.53 1.75 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.432 -0.792 . . . . 0.0 109.85 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.48 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -57.4 -20.18 28.2 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.268 -0.895 . . . . 0.0 109.763 179.532 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.653 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -77.99 -32.99 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.815 . . . . 0.0 109.987 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.475 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 20.4 m95 -76.43 -43.66 39.18 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.905 . . . . 0.0 110.267 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.47 -54.51 46.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.338 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.506 ' NH1' ' HG2' ' A' ' 25' ' ' ARG . 8.4 mtt-85 -69.04 -14.15 62.86 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.23 -0.919 . . . . 0.0 110.184 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.885 HD22 HD11 ' A' ' 106' ' ' LEU . 4.2 mt -77.87 -24.82 48.41 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.215 -0.928 . . . . 0.0 110.189 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 C--N 1.302 -1.488 0 O-C-N 121.417 -0.802 . . . . 0.0 109.806 -179.776 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.479 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 25.1 p-90 . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 121.225 0.536 . . . . 0.0 110.043 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.3 -47.49 36.47 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.092 -1.005 . . . . 0.0 109.983 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -40.15 61.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.235 -0.916 . . . . 0.0 109.984 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.754 HG11 HD22 ' A' ' 106' ' ' LEU . 49.5 t -63.09 -57.6 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.421 -0.799 . . . . 0.0 110.25 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.569 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 11.2 t80 -44.76 -55.7 5.1 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.456 -0.777 . . . . 0.0 110.161 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.555 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 12.3 mmtt -61.71 -31.43 71.58 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.239 -0.913 . . . . 0.0 110.069 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.828 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -66.98 -24.4 66.04 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.243 -0.91 . . . . 0.0 109.754 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.661 ' HG2' HD21 ' A' ' 64' ' ' LEU . 0.3 OUTLIER -79.44 -31.4 42.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.359 -0.838 . . . . 0.0 110.144 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 93.5 m -68.58 -35.33 77.23 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.253 -0.904 . . . . 0.0 110.328 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.792 HD21 HG22 ' A' ' 24' ' ' VAL . 30.9 tp -73.25 -36.66 66.42 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.206 -0.934 . . . . 0.0 109.764 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.647 ' O ' HD12 ' A' ' 85' ' ' ILE . 3.6 ttp -71.0 -34.75 71.67 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.167 -0.958 . . . . 0.0 109.823 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.548 ' HB2' HD13 ' A' ' 130' ' ' LEU . 16.4 tt0 -75.72 -36.14 60.05 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.319 -0.863 . . . . 0.0 110.81 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.564 ' O ' HG22 ' A' ' 87' ' ' THR . 54.0 t80 -72.18 -42.77 65.49 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.168 -0.957 . . . . 0.0 110.455 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.647 HD22 ' HA ' ' A' ' 44' ' ' ALA . 53.8 mt -71.42 -29.1 64.5 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.154 -0.966 . . . . 0.0 110.304 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.714 HG13 HG12 ' A' ' 92' ' ' VAL . 22.6 mt -64.0 -23.17 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.115 -0.991 . . . . 0.0 109.883 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -98.98 -69.58 0.76 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.946 . . . . 0.0 110.167 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.564 HG22 ' O ' ' A' ' 83' ' ' TYR . 14.3 t -84.39 -27.18 27.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.253 -0.904 . . . . 0.0 110.238 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.514 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -48.51 -73.42 0.34 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 7.2 t 174.35 162.91 0.2 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -1.143 . . . . 0.0 110.199 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -62.27 -12.69 22.0 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.274 -0.891 . . . . 0.0 110.199 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.484 ' NH2' ' HG3' ' A' ' 94' ' ' GLN . 5.9 mmp_? -79.01 -43.05 25.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.259 -0.901 . . . . 0.0 110.265 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.714 HG12 HG13 ' A' ' 85' ' ' ILE . 82.4 t -60.13 -26.0 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.189 -0.944 . . . . 0.0 109.955 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.82 -31.42 23.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.31 -0.869 . . . . 0.0 109.732 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.484 ' HG3' ' NH2' ' A' ' 91' ' ' ARG . 13.3 mm100 -67.95 -48.69 65.18 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.302 -0.874 . . . . 0.0 109.807 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -59.42 -36.88 76.7 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.34 -0.85 . . . . 0.0 109.585 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.712 ' HB3' HD13 ' A' ' 134' ' ' LEU . 44.5 m -56.96 -42.18 79.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.392 -0.817 . . . . 0.0 109.524 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.0 tttp -68.48 -29.07 67.6 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.461 -0.774 . . . . 0.0 109.679 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -83.64 -14.59 51.55 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.387 -0.821 . . . . 0.0 110.077 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -126.21 39.78 3.87 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.364 -0.835 . . . . 0.0 110.271 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 6.1 ttm -65.5 -30.07 70.8 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.186 -0.947 . . . . 0.0 110.206 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.449 ' O ' ' HB ' ' A' ' 105' ' ' THR . 59.7 m-85 -64.39 -12.59 44.29 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.288 -0.883 . . . . 0.0 110.018 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.835 ' O ' HG22 ' A' ' 105' ' ' THR . . . -90.61 -40.67 11.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 110.224 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.443 HG12 HG23 ' A' ' 131' ' ' VAL . 2.4 t -75.94 -21.01 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.322 -0.862 . . . . 0.0 109.911 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -91.53 -26.43 18.77 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.373 -0.83 . . . . 0.0 110.316 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.835 HG22 ' O ' ' A' ' 102' ' ' ALA . 9.2 t -65.4 -16.04 63.21 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.91 . . . . 0.0 110.177 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.885 HD11 HD22 ' A' ' 64' ' ' LEU . 15.4 mt -70.58 -39.85 73.62 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.283 -0.886 . . . . 0.0 110.336 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.331 -0.855 . . . . 0.0 110.195 179.898 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.0 p . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 121.488 0.661 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.9 OUTLIER -50.88 -49.31 59.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.452 -0.78 . . . . 0.0 110.498 -179.838 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.612 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 9.7 p -77.3 -16.0 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.164 -0.96 . . . . 0.0 110.398 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -66.97 0.78 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.197 -0.939 . . . . 0.0 110.599 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.475 ' CG ' ' N ' ' A' ' 126' ' ' LYS . 13.8 pt-20 -60.02 -43.62 95.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.398 -0.814 . . . . 0.0 110.679 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.569 ' HG3' ' CE1' ' A' ' 75' ' ' TYR . 7.4 tmtm? -54.55 -51.64 64.6 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.125 -0.985 . . . . 0.0 110.161 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.564 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -53.99 -41.37 67.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.145 -0.972 . . . . 0.0 110.15 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.423 ' HB3' ' HE2' ' A' ' 128' ' ' LYS . 30.0 ttpt -58.21 -39.93 80.28 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.226 -0.921 . . . . 0.0 110.041 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.459 ' HB2' ' O ' ' A' ' 126' ' ' LYS . 28.9 mt-30 -57.3 -48.61 78.5 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.305 -0.872 . . . . 0.0 110.174 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.58 ' O ' HD12 ' A' ' 134' ' ' LEU . 9.2 tp -57.59 -28.78 63.92 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.172 -0.955 . . . . 0.0 109.677 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.443 HG23 HG12 ' A' ' 103' ' ' VAL . 43.1 t -78.29 -27.9 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.343 -0.848 . . . . 0.0 109.513 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.61 -53.35 12.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.461 -0.774 . . . . 0.0 110.252 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.2 mp -56.13 -32.71 64.48 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.231 -0.918 . . . . 0.0 110.176 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.712 HD13 ' HB3' ' A' ' 96' ' ' CYS . 31.4 mt . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 0.0 110.192 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.534 ' HG2' HD12 ' A' ' 22' ' ' ILE . 38.0 mt-10 . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.216 0.531 . . . . 0.0 110.122 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.896 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -66.68 -56.54 10.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.265 -0.897 . . . . 0.0 110.221 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.412 ' C ' ' O ' ' A' ' 20' ' ' ALA . 15.1 pt-20 -42.97 -29.55 0.34 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.306 -0.871 . . . . 0.0 110.197 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.534 HD12 ' HG2' ' A' ' 19' ' ' GLU . 36.4 mt -79.78 -48.73 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.255 -0.903 . . . . 0.0 110.121 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.55 ' O ' HD11 ' A' ' 43' ' ' ILE . 2.6 mmtm -50.46 -35.75 30.34 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 0.0 110.037 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.654 HG13 ' CD2' ' A' ' 80' ' ' LEU . 98.3 t -72.46 -48.15 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.333 -0.855 . . . . 0.0 110.106 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.71 -51.2 40.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.176 -0.952 . . . . 0.0 110.009 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -65.69 -29.17 69.68 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.936 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.789 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -74.28 -19.51 60.47 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.275 -0.891 . . . . 0.0 110.022 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 76' ' ' LYS . 34.5 p . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.328 -0.858 . . . . 0.0 110.262 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.789 HD21 ' HB2' ' A' ' 27' ' ' ALA . 1.3 tp . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.293 0.568 . . . . 0.0 110.234 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.5 mtt -60.03 -51.9 67.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.157 -0.964 . . . . 0.0 110.195 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 98.0 p -52.78 -26.32 13.97 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.201 -0.937 . . . . 0.0 110.141 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 8.3 mm-40 -78.08 -54.99 5.65 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.251 -0.906 . . . . 0.0 110.2 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.766 HG21 HD11 ' A' ' 80' ' ' LEU . 54.6 mt -51.83 -38.11 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.187 -0.945 . . . . 0.0 109.998 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.492 ' CA ' HD22 ' A' ' 84' ' ' LEU . . . -68.61 -53.16 24.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.09 -1.006 . . . . 0.0 109.269 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.5 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 4.9 t70 -51.25 -22.06 2.49 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.13 -0.981 . . . . 0.0 109.147 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.896 HD22 ' HB2' ' A' ' 20' ' ' ALA . 8.5 mt -80.15 -39.72 28.81 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.5 -0.75 . . . . 0.0 110.053 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.782 HG21 ' HB3' ' A' ' 84' ' ' LEU . 81.7 p -48.54 -38.98 21.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.094 -1.004 . . . . 0.0 109.26 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.585 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 63.3 m-85 -45.28 -49.62 12.45 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.401 -0.92 . . . . 0.0 109.442 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.544 ' O ' ' C ' ' A' ' 50' ' ' VAL . 49.2 m-20 -70.49 92.29 0.82 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.672 -0.642 . . . . 0.0 110.8 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.544 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -12.16 -57.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.21 178.095 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.551 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.6 t -62.54 -64.85 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.07 -1.019 . . . . 0.0 109.888 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.632 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -38.03 -40.98 0.53 Allowed 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.302 0.572 . . . . 0.0 110.568 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.61 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 29.1 t80 -64.81 -57.48 8.77 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.453 -0.779 . . . . 0.0 110.265 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -26.82 9.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.213 -0.929 . . . . 0.0 110.016 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -84.17 -31.72 24.99 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.238 -0.914 . . . . 0.0 109.981 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.824 HD11 ' HB3' ' A' ' 46' ' ' LEU . 17.0 mt -74.66 -68.48 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.396 -0.815 . . . . 0.0 110.117 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.61 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 14.1 mmm -43.8 -38.83 3.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.267 -0.896 . . . . 0.0 109.729 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.83 -59.87 3.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.394 -0.816 . . . . 0.0 109.951 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 16.4 mmt -60.11 -21.94 62.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.263 -0.898 . . . . 0.0 109.896 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.666 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -76.92 -28.28 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.425 -0.797 . . . . 0.0 109.878 179.898 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 14.4 m95 -81.99 -29.54 32.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.276 -0.89 . . . . 0.0 110.373 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -58.54 3.4 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.378 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -64.57 -24.02 67.46 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.185 -0.947 . . . . 0.0 110.139 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.99 HD22 HD11 ' A' ' 106' ' ' LEU . 5.6 mt -66.14 -16.28 63.83 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.0 110.392 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.9 m-20 . . . . . 0 C--N 1.302 -1.461 0 O-C-N 121.293 -0.879 . . . . 0.0 110.058 -179.528 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.435 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 19.6 p-90 . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.168 0.509 . . . . 0.0 110.381 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 39.2 mtt85 -48.93 -46.21 42.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.107 -0.996 . . . . 0.0 110.092 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 68.2 m80 -58.73 -48.88 79.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.227 -0.92 . . . . 0.0 110.107 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.744 HG12 HG13 ' A' ' 123' ' ' VAL . 16.9 t -46.62 -44.72 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.269 -0.895 . . . . 0.0 110.181 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.51 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 4.0 t80 -55.72 -54.87 39.02 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.251 -0.906 . . . . 0.0 110.283 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.556 ' O ' HG22 ' A' ' 28' ' ' THR . 0.2 OUTLIER -71.17 -9.11 57.52 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.898 -1.126 . . . . 0.0 109.52 179.525 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.934 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -79.16 -70.2 0.52 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.395 -0.815 . . . . 0.0 110.941 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.574 ' HE1' HG13 ' A' ' 123' ' ' VAL . 0.7 OUTLIER -56.63 -26.7 56.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.114 -0.991 . . . . 0.0 110.105 -179.487 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.426 ' O ' ' C ' ' A' ' 80' ' ' LEU . 61.2 m -63.65 -65.2 0.71 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.031 -1.043 . . . . 0.0 109.439 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.766 HD11 HG21 ' A' ' 43' ' ' ILE . 10.6 tp -42.67 -59.0 2.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.502 -0.748 . . . . 0.0 109.316 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.483 ' HE2' ' SG ' ' A' ' 96' ' ' CYS . 19.4 ttt -42.9 -46.08 5.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.359 -0.838 . . . . 0.0 109.836 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.653 ' HB2' HD12 ' A' ' 130' ' ' LEU . 40.8 tt0 -58.81 -48.57 80.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.356 -0.84 . . . . 0.0 109.779 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.424 ' CE1' HG21 ' A' ' 87' ' ' THR . 22.9 t80 -54.48 -37.39 65.2 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.41 -0.806 . . . . 0.0 110.183 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.92 ' HB2' HG11 ' A' ' 92' ' ' VAL . 2.6 mt -74.67 -28.45 60.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.273 -0.892 . . . . 0.0 110.007 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.994 HD13 HD11 ' A' ' 134' ' ' LEU . 32.2 mt -70.22 -26.05 28.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.037 -1.039 . . . . 0.0 109.962 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -88.77 -68.68 0.75 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.261 -0.9 . . . . 0.0 110.383 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.438 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 14.5 t -95.1 -22.73 17.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.201 -0.937 . . . . 0.0 110.49 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.585 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -47.68 -77.17 0.12 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 88' ' ' GLY . 6.2 p -178.71 171.45 1.48 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.169 -1.195 . . . . 0.0 110.301 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -71.47 -13.8 61.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.272 -0.892 . . . . 0.0 110.219 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 15.7 mmt180 -79.48 -41.51 27.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.25 -0.906 . . . . 0.0 109.989 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.92 HG11 ' HB2' ' A' ' 84' ' ' LEU . 93.3 t -56.26 -33.24 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.263 -0.898 . . . . 0.0 109.865 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.47 ' O ' ' HB3' ' A' ' 96' ' ' CYS . 1.6 t -76.15 -40.97 51.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.289 -0.882 . . . . 0.0 109.849 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -57.18 -56.58 19.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -0.869 . . . . 0.0 109.861 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -52.92 -38.75 62.22 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.361 -0.837 . . . . 0.0 109.568 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.483 ' SG ' ' HE2' ' A' ' 81' ' ' MET . 48.9 t -54.67 -43.84 72.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.359 -0.838 . . . . 0.0 109.693 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -65.44 -35.81 82.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.352 -0.842 . . . . 0.0 109.675 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -78.24 -12.68 60.01 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.421 -0.799 . . . . 0.0 109.842 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -134.04 30.41 3.65 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.458 -0.776 . . . . 0.0 110.119 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 4.9 ptt? -62.99 -24.92 68.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.178 -0.951 . . . . 0.0 110.009 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.469 ' O ' ' HB ' ' A' ' 105' ' ' THR . 2.7 m-85 -65.76 -23.84 66.82 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.213 -0.929 . . . . 0.0 109.99 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.991 ' O ' HG22 ' A' ' 105' ' ' THR . . . -78.37 -40.89 34.91 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.381 -0.825 . . . . 0.0 110.193 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.701 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 5.3 t -72.17 -27.64 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.306 -0.871 . . . . 0.0 110.151 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.78 ' HG2' HG21 ' A' ' 131' ' ' VAL . 3.4 mm100 -86.84 -29.36 22.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.327 -0.858 . . . . 0.0 110.372 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.991 HG22 ' O ' ' A' ' 102' ' ' ALA . 11.0 t -57.59 -19.38 25.45 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.236 -0.915 . . . . 0.0 110.232 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.99 HD11 HD22 ' A' ' 64' ' ' LEU . 20.4 mt -68.97 -40.65 78.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.251 -0.906 . . . . 0.0 110.255 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 14.9 ttpp . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.235 -0.916 . . . . 0.0 110.196 179.836 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.564 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.2 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.282 0.563 . . . . 0.0 110.071 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.564 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.6 m-80 -36.6 -30.11 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.218 0.533 . . . . 0.0 110.64 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.744 HG13 HG12 ' A' ' 74' ' ' VAL . 12.6 t -72.7 -62.12 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.339 -0.851 . . . . 0.0 110.283 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -44.47 -43.82 8.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.251 -0.905 . . . . 0.0 110.658 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.539 ' HG3' ' N ' ' A' ' 126' ' ' LYS . 10.0 pt-20 -75.39 -32.22 60.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.276 -0.89 . . . . 0.0 110.717 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.539 ' N ' ' HG3' ' A' ' 125' ' ' GLU . 33.4 tptt -62.07 -52.89 62.08 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.97 -1.081 . . . . 0.0 110.247 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.701 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -58.26 -41.42 84.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.302 -0.874 . . . . 0.0 110.267 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 11.6 tttm -59.67 -38.29 81.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.23 -0.919 . . . . 0.0 110.305 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -62.32 -40.62 96.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.281 -0.887 . . . . 0.0 110.6 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.653 HD12 ' HB2' ' A' ' 82' ' ' GLU . 7.9 tt -61.17 -40.39 93.71 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.08 -1.012 . . . . 0.0 110.508 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.78 HG21 ' HG2' ' A' ' 104' ' ' GLN . 54.0 t -77.45 -24.96 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.321 -0.862 . . . . 0.0 110.475 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.0 -52.61 18.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.234 -0.916 . . . . 0.0 110.573 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.742 HD12 ' C ' ' A' ' 133' ' ' LEU . 3.5 pp -66.31 -22.16 66.28 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.181 -0.95 . . . . 0.0 110.371 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.994 HD11 HD13 ' A' ' 85' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 O-C-N 121.268 -0.895 . . . . 0.0 110.466 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 121.242 0.544 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.913 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -60.42 -45.58 93.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.266 -0.896 . . . . 0.0 110.286 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.501 ' HG3' HG13 ' A' ' 22' ' ' ILE . 9.4 pt-20 -43.39 -40.94 3.93 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 110.051 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.501 HG13 ' HG3' ' A' ' 21' ' ' GLU . 37.3 mt -69.45 -40.46 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.2 -0.938 . . . . 0.0 109.968 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 1.0 OUTLIER -59.53 -61.72 2.41 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.287 -0.883 . . . . 0.0 110.122 179.814 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.829 HG13 HD23 ' A' ' 80' ' ' LEU . 84.2 t -48.35 -33.33 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.241 -0.912 . . . . 0.0 110.052 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.415 ' HB3' ' O ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER -64.6 -46.39 82.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.374 -0.829 . . . . 0.0 110.244 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.01 -17.13 61.03 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.384 -0.822 . . . . 0.0 110.19 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.942 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -79.7 -28.1 40.67 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 110.152 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 77.4 p . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.24 -0.912 . . . . 0.0 110.142 179.898 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.942 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.27 0.557 . . . . 0.0 110.18 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.0 mtp -66.99 -52.36 43.57 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.275 -0.891 . . . . 0.0 110.149 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 t -55.04 -32.08 61.6 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.269 -0.894 . . . . 0.0 110.221 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.94 -46.4 52.7 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.257 -0.902 . . . . 0.0 110.218 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.468 ' O ' ' HB2' ' A' ' 46' ' ' LEU . 68.6 mt -59.81 -31.01 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.129 -0.982 . . . . 0.0 109.853 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.577 ' HA ' HD22 ' A' ' 84' ' ' LEU . . . -70.65 -51.43 27.94 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.135 -0.978 . . . . 0.0 109.434 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.435 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 38.4 t0 -52.68 -21.08 3.6 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.076 -1.015 . . . . 0.0 108.886 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.913 HD13 ' CB ' ' A' ' 20' ' ' ALA . 15.5 mt -79.81 -38.31 33.23 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.488 -0.757 . . . . 0.0 110.247 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.535 ' HA ' ' CA ' ' A' ' 53' ' ' PHE . 55.3 p -52.49 -45.41 66.15 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.946 -1.096 . . . . 0.0 109.063 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.435 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 90.4 m-85 -43.58 -41.98 4.84 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.38 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.535 ' O ' ' N ' ' A' ' 51' ' ' VAL . 0.3 OUTLIER -73.51 91.43 1.81 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.577 -0.702 . . . . 0.0 110.183 179.531 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.532 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.09 -59.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.571 178.309 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.544 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -65.05 -65.78 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.104 -0.998 . . . . 0.0 110.203 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.811 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -35.64 -46.56 0.43 Allowed 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.099 -177.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.535 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 4.7 t80 -55.4 -56.75 16.58 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.279 -0.888 . . . . 0.0 110.289 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.488 ' O ' ' HB2' ' A' ' 58' ' ' SER . 88.9 p -52.1 -38.88 58.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.206 -0.934 . . . . 0.0 110.245 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -70.14 -29.73 66.73 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.431 -0.793 . . . . 0.0 110.39 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.79 ' HA ' HG21 ' A' ' 24' ' ' VAL . 11.2 mt -77.55 -70.28 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.187 -0.946 . . . . 0.0 110.281 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.54 ' HG3' ' NE1' ' A' ' 61' ' ' TRP . 1.9 tpt -47.19 -34.6 6.48 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.144 -0.972 . . . . 0.0 110.031 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 54' ' ' SER . 32.5 t -57.23 -61.82 2.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.333 -0.854 . . . . 0.0 110.108 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.4 mmt -58.21 -26.62 63.06 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.199 -0.938 . . . . 0.0 109.941 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.773 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -71.6 -31.07 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.299 -0.876 . . . . 0.0 109.88 179.747 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.54 ' NE1' ' HG3' ' A' ' 57' ' ' MET . 11.0 m95 -77.47 -42.93 34.07 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.277 -0.889 . . . . 0.0 110.386 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -60.5 3.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.283 -0.886 . . . . 0.0 110.605 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -13.04 57.96 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.187 -0.946 . . . . 0.0 110.578 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 1.022 HD22 HD11 ' A' ' 106' ' ' LEU . 2.4 mt -74.99 -13.43 60.51 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.162 -0.961 . . . . 0.0 110.576 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.303 -1.456 0 O-C-N 121.15 -0.969 . . . . 0.0 110.379 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.47 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 33.7 p-90 . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.273 0.559 . . . . 0.0 110.096 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.411 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 14.9 mtt180 -50.69 -42.98 57.46 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.242 -0.911 . . . . 0.0 109.945 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.3 m170 -54.56 -39.62 67.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.321 -0.862 . . . . 0.0 109.835 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.756 HG11 ' CG1' ' A' ' 123' ' ' VAL . 42.7 t -60.64 -51.27 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.314 -0.866 . . . . 0.0 109.759 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 74' ' ' VAL . 2.2 t80 -41.79 -61.55 1.08 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.393 -0.817 . . . . 0.0 110.261 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.03 -28.98 70.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.271 -0.893 . . . . 0.0 110.195 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.949 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -61.24 -70.32 0.19 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.185 -0.947 . . . . 0.0 110.166 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.656 ' HE2' HG12 ' A' ' 74' ' ' VAL . 3.0 ptp -50.49 -26.61 5.33 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.398 -0.814 . . . . 0.0 110.023 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 61.2 m -66.68 -47.27 72.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.272 -0.892 . . . . 0.0 109.937 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.829 HD23 HG13 ' A' ' 24' ' ' VAL . 16.6 tp -64.22 -29.7 70.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.428 -0.795 . . . . 0.0 109.838 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.788 ' HG2' HD21 ' A' ' 130' ' ' LEU . 5.2 ttp -71.86 -35.17 69.74 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.333 -0.854 . . . . 0.0 109.893 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.44 ' CB ' HD13 ' A' ' 130' ' ' LEU . 46.2 tt0 -70.87 -56.41 6.34 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.298 -0.876 . . . . 0.0 110.22 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -52.56 -45.06 66.25 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.289 -0.882 . . . . 0.0 110.74 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.608 ' CB ' HG11 ' A' ' 92' ' ' VAL . 59.8 mt -73.0 -29.68 63.21 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.935 . . . . 0.0 110.791 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.635 HG13 HG12 ' A' ' 92' ' ' VAL . 8.5 mt -61.19 -14.28 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 120.859 -1.151 . . . . 0.0 109.635 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 43.0 mttt -107.03 -77.76 0.59 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.241 -0.912 . . . . 0.0 109.97 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.459 HG23 ' HB1' ' A' ' 44' ' ' ALA . 13.5 t -82.49 2.88 30.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.881 . . . . 0.0 110.019 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -93.39 30.06 7.66 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.2 OUTLIER 75.74 148.59 0.1 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.58 -0.953 . . . . 0.0 110.41 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.3 -9.72 13.01 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.48 -0.763 . . . . 0.0 110.542 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 -71.46 -43.13 67.19 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.184 -0.948 . . . . 0.0 109.836 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.635 HG12 HG13 ' A' ' 85' ' ' ILE . 99.3 t -55.98 -32.85 34.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.481 -0.762 . . . . 0.0 110.324 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.514 ' OG ' HG23 ' A' ' 85' ' ' ILE . 1.1 t -81.56 -41.81 21.05 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.239 -0.913 . . . . 0.0 110.27 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -55.12 -54.18 46.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.0 109.961 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.483 ' HG2' ' HE2' ' A' ' 57' ' ' MET . 11.1 tt0 -54.18 -39.46 66.62 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.408 -0.807 . . . . 0.0 109.657 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.554 ' SG ' HD11 ' A' ' 134' ' ' LEU . 0.1 OUTLIER -55.26 -43.01 74.27 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.318 -0.864 . . . . 0.0 109.644 179.527 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -68.12 -31.22 70.66 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.435 -0.791 . . . . 0.0 109.704 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -75.62 -19.84 58.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.432 -0.793 . . . . 0.0 109.798 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -122.07 40.67 3.59 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.411 -0.806 . . . . 0.0 110.033 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' MET . . . . . 0.458 ' O ' ' HB2' ' A' ' 104' ' ' GLN . 0.2 OUTLIER -56.15 -22.64 29.92 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.27 -0.894 . . . . 0.0 110.343 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.443 ' N ' ' HG2' ' A' ' 100' ' ' MET . 2.3 m-30 -76.57 -32.26 58.06 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -0.916 . . . . 0.0 110.256 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.816 ' O ' HG22 ' A' ' 105' ' ' THR . . . -74.5 -39.41 62.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 110.219 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.733 HG23 ' CE ' ' A' ' 81' ' ' MET . 3.2 p -74.26 -42.43 50.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 O-C-N 121.287 -0.883 . . . . 0.0 109.304 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.568 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 67.3 mt-30 -71.94 -20.16 61.8 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.596 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.816 HG22 ' O ' ' A' ' 102' ' ' ALA . 5.1 t -53.34 -28.28 27.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.951 -1.093 . . . . 0.0 110.056 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 1.022 HD11 HD22 ' A' ' 64' ' ' LEU . 75.5 mt -71.94 -35.32 69.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.874 . . . . 0.0 110.263 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.511 ' HA ' ' HG2' ' A' ' 124' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.625 0 O-C-N 121.234 -0.916 . . . . 0.0 110.087 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.563 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.7 p . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.301 0.572 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.563 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.2 m-20 -37.43 -28.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.76 -0.588 . . . . 0.0 110.76 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.756 ' CG1' HG11 ' A' ' 74' ' ' VAL . 7.1 t -85.29 -64.73 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.243 -0.91 . . . . 0.0 110.211 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.511 ' HG2' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -40.6 -36.27 0.57 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.146 -0.971 . . . . 0.0 111.05 -179.467 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.47 ' O ' ' HB3' ' A' ' 128' ' ' LYS . 17.5 mm-40 -81.36 -50.81 9.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.119 -0.988 . . . . 0.0 111.191 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.452 ' HB3' ' SD ' ' A' ' 78' ' ' MET . 0.0 OUTLIER -53.59 -56.78 14.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.075 -1.016 . . . . 0.0 109.73 -179.786 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.571 ' O ' HG23 ' A' ' 131' ' ' VAL . . . -53.78 -41.36 67.16 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.398 -0.814 . . . . 0.0 110.058 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -50.78 -40.7 55.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.125 -0.984 . . . . 0.0 110.175 179.917 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -65.21 -53.1 49.64 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 110.177 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.788 HD21 ' HG2' ' A' ' 81' ' ' MET . 17.1 tp -48.58 -32.03 7.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.216 -0.928 . . . . 0.0 110.13 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 127' ' ' ALA . 21.4 t -78.73 -35.05 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.391 -0.818 . . . . 0.0 110.106 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.78 -52.71 55.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 0.0 110.185 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.19 -44.6 83.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.3 -0.875 . . . . 0.0 110.186 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.554 HD11 ' SG ' ' A' ' 96' ' ' CYS . 5.9 mt . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.246 -0.909 . . . . 0.0 110.346 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.283 0.563 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.559 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -72.46 -42.35 65.07 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.186 -0.946 . . . . 0.0 110.265 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.476 ' HG3' HG12 ' A' ' 22' ' ' ILE . 17.2 pt-20 -43.23 -34.41 1.15 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.257 -0.902 . . . . 0.0 110.01 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.476 HG12 ' HG3' ' A' ' 21' ' ' GLU . 25.0 mm -79.83 -50.24 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.383 -0.823 . . . . 0.0 109.811 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.776 ' O ' HD11 ' A' ' 43' ' ' ILE . 4.1 mptt -48.76 -27.99 3.33 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.281 -0.887 . . . . 0.0 110.096 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.757 HG21 ' HA ' ' A' ' 56' ' ' ILE . 91.6 t -85.42 -33.62 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.263 -0.898 . . . . 0.0 110.014 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -62.87 -43.27 99.24 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.249 -0.907 . . . . 0.0 109.921 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -33.31 61.76 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.484 -0.76 . . . . 0.0 110.061 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.629 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -64.57 -23.17 67.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.333 -0.854 . . . . 0.0 110.13 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.476 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 40.7 p . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.241 -0.912 . . . . 0.0 110.223 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.885 ' O ' HD12 ' A' ' 43' ' ' ILE . 4.5 tp . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 121.157 0.503 . . . . 0.0 110.712 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 2.9 mtt -96.71 -43.7 7.43 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.186 -0.946 . . . . 0.0 109.869 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.0 t -67.33 -28.8 68.28 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.334 -0.854 . . . . 0.0 110.374 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.46 ' O ' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -73.4 -50.37 22.17 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.25 -0.906 . . . . 0.0 110.359 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.935 HG21 HD11 ' A' ' 80' ' ' LEU . 20.9 mt -56.34 -36.62 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.234 -0.916 . . . . 0.0 110.272 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.751 ' CB ' HG23 ' A' ' 87' ' ' THR . . . -70.05 -48.49 57.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.064 -1.023 . . . . 0.0 109.486 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.462 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -53.49 -20.68 5.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.047 -1.033 . . . . 0.0 108.995 178.856 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.741 ' HB3' HD11 ' A' ' 56' ' ' ILE . 15.6 mt -81.5 -36.91 28.69 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.499 -0.751 . . . . 0.0 109.884 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.516 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 67.9 p -51.92 -43.42 63.41 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.269 -0.972 . . . . 0.0 109.038 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 93.4 m-85 -45.02 -43.3 9.11 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.433 -0.907 . . . . 0.0 109.399 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 50' ' ' VAL . 0.8 OUTLIER -71.78 90.47 1.09 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.551 -0.718 . . . . 0.0 110.51 179.631 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.02 -58.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.609 178.175 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.544 HG12 ' N ' ' A' ' 52' ' ' ALA . 3.0 t -66.11 -66.26 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.052 -1.03 . . . . 0.0 110.345 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.62 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -35.46 -42.9 0.23 Allowed 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.16 0.505 . . . . 0.0 110.833 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.593 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 32.0 t80 -58.91 -55.16 38.69 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.413 -0.804 . . . . 0.0 110.21 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.7 t -53.92 -28.18 35.34 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.316 -0.865 . . . . 0.0 109.924 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.38 -30.37 37.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.297 -0.877 . . . . 0.0 109.997 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.757 ' HA ' HG21 ' A' ' 24' ' ' VAL . 6.7 mt -75.89 -65.8 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.398 -0.814 . . . . 0.0 109.963 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.593 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 89.4 mmm -45.94 -34.49 3.97 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.21 -0.931 . . . . 0.0 109.792 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.6 m -57.7 -63.99 1.05 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.333 -0.854 . . . . 0.0 110.108 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.471 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.4 OUTLIER -57.93 -20.21 35.78 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.946 . . . . 0.0 110.104 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.786 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -79.67 -30.6 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.337 -0.852 . . . . 0.0 109.979 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.56 ' CD1' ' O ' ' A' ' 57' ' ' MET . 21.6 m95 -80.94 -44.74 17.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.162 -0.962 . . . . 0.0 110.162 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.73 -44.37 85.95 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.289 -0.882 . . . . 0.0 109.813 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -73.75 -14.42 61.12 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.0 109.942 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.921 HD22 HD11 ' A' ' 106' ' ' LEU . 10.1 mt -85.0 -19.49 31.94 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.304 -0.872 . . . . 0.0 110.312 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.404 0 O-C-N 121.247 -0.908 . . . . 0.0 110.141 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.551 ' CZ3' ' HA ' ' A' ' 72' ' ' ARG . 21.7 p-90 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.116 0.484 . . . . 0.0 110.12 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.551 ' HA ' ' CZ3' ' A' ' 71' ' ' TRP . 11.8 ptm180 -42.83 -33.18 0.72 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.309 -0.87 . . . . 0.0 110.138 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.425 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 1.3 m-70 -68.28 -48.58 64.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.197 -0.939 . . . . 0.0 109.961 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.606 HG12 HG22 ' A' ' 123' ' ' VAL . 79.5 t -53.53 -50.78 47.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 0.0 109.978 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.629 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 2.8 t80 -50.42 -58.97 4.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.215 -0.928 . . . . 0.0 109.979 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.476 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 4.9 mttt -56.62 -25.3 52.72 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.363 -0.836 . . . . 0.0 110.09 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.794 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -73.85 -34.19 64.4 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.89 . . . . 0.0 110.207 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.718 ' HE1' HG13 ' A' ' 123' ' ' VAL . 0.4 OUTLIER -65.59 -34.73 78.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.346 -0.846 . . . . 0.0 110.029 179.841 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 44.5 m -67.99 -59.68 3.08 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 110.317 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.935 HD11 HG21 ' A' ' 43' ' ' ILE . 25.6 tp -47.51 -55.1 9.82 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.31 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' MET . . . . . 1.051 ' HG2' HD21 ' A' ' 130' ' ' LEU . 2.0 tpt -51.3 -35.57 38.4 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.113 -0.992 . . . . 0.0 110.29 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.753 ' HA ' HD12 ' A' ' 85' ' ' ILE . 26.4 tt0 -71.31 -64.86 0.83 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.183 -0.948 . . . . 0.0 110.418 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 1.098 ' CE1' HG21 ' A' ' 87' ' ' THR . 45.3 t80 -43.8 -38.05 3.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.207 -0.933 . . . . 0.0 110.955 -179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.687 HD23 ' HB2' ' A' ' 44' ' ' ALA . 68.8 mt -76.81 -34.36 57.94 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.124 -0.985 . . . . 0.0 110.751 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.016 HD13 HD21 ' A' ' 134' ' ' LEU . 10.6 mt -50.89 -21.2 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.924 -1.11 . . . . 0.0 109.722 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.69 -77.45 0.57 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.232 -0.917 . . . . 0.0 110.156 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' THR . . . . . 1.098 HG21 ' CE1' ' A' ' 83' ' ' TYR . 13.0 t -61.85 -13.92 28.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.251 -0.906 . . . . 0.0 110.147 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.668 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -88.82 30.9 5.19 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.495 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 71.47 157.15 0.17 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.318 -1.107 . . . . 0.0 110.431 179.961 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -66.95 -7.19 20.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.424 -0.798 . . . . 0.0 110.485 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -73.09 -40.38 65.05 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 0.0 109.714 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.685 HG11 ' CB ' ' A' ' 84' ' ' LEU . 86.8 t -61.09 -35.15 63.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.315 -0.866 . . . . 0.0 109.855 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.4 t -75.51 -43.84 46.87 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.156 -0.965 . . . . 0.0 109.678 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -56.79 -37.5 71.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.0 109.603 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -65.22 -41.51 94.37 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.348 -0.845 . . . . 0.0 109.288 179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.427 ' SG ' ' HE2' ' A' ' 81' ' ' MET . 4.6 t -54.22 -42.21 69.55 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.333 -0.854 . . . . 0.0 109.236 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.59 -34.17 77.6 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.505 -0.747 . . . . 0.0 109.351 179.283 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -78.77 -13.68 59.68 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.532 -0.73 . . . . 0.0 109.702 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -134.51 35.52 3.18 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.461 -0.774 . . . . 0.0 110.017 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.8 mtm -63.04 -28.44 70.1 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.245 -0.91 . . . . 0.0 110.133 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.47 ' O ' ' HB ' ' A' ' 105' ' ' THR . 44.0 m-85 -63.04 -22.66 67.01 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -0.89 . . . . 0.0 109.935 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.953 ' O ' HG22 ' A' ' 105' ' ' THR . . . -77.56 -41.12 40.07 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.309 -0.869 . . . . 0.0 110.069 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.498 HG13 HD23 ' A' ' 130' ' ' LEU . 3.4 t -74.75 -26.46 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.392 -0.817 . . . . 0.0 109.967 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.485 ' OE1' HG21 ' A' ' 131' ' ' VAL . 17.4 mm100 -85.64 -25.96 26.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.303 -0.873 . . . . 0.0 110.153 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.953 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.5 t -62.19 -23.88 66.87 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.241 -0.912 . . . . 0.0 110.154 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.921 HD11 HD22 ' A' ' 64' ' ' LEU . 13.5 mt -65.03 -40.51 94.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.186 -0.946 . . . . 0.0 110.177 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.409 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 13.7 ttpp . . . . . 0 N--CA 1.49 1.575 0 O-C-N 121.181 -0.949 . . . . 0.0 109.884 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.814 HG22 ' OE1' ' A' ' 125' ' ' GLU . 4.2 p . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 121.473 0.654 . . . . 0.0 110.376 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.577 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 3.1 m-80 -46.26 -31.41 2.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.213 -0.929 . . . . 0.0 110.258 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.718 HG13 ' HE1' ' A' ' 78' ' ' MET . 2.0 t -83.13 -55.2 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.25 -0.906 . . . . 0.0 110.361 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.42 ' N ' HG12 ' A' ' 123' ' ' VAL . 2.2 tmt_? -47.74 -49.78 27.32 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.009 -1.057 . . . . 0.0 111.073 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.814 ' OE1' HG22 ' A' ' 121' ' ' VAL . 21.4 mt-10 -64.85 -53.22 50.2 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.257 -0.902 . . . . 0.0 111.505 -179.164 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.629 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -50.13 -45.43 52.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.982 -1.074 . . . . 0.0 110.682 -179.242 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.24 -42.93 83.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.22 -0.925 . . . . 0.0 110.396 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -45.9 -55.99 6.01 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.184 -0.948 . . . . 0.0 110.276 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -58.56 -51.1 71.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 0.0 110.333 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 1.051 HD21 ' HG2' ' A' ' 81' ' ' MET . 25.6 tp -46.09 -27.78 1.04 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.246 -0.909 . . . . 0.0 110.316 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.485 HG21 ' OE1' ' A' ' 104' ' ' GLN . 25.6 t -89.87 -33.87 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.208 -0.933 . . . . 0.0 110.284 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.82 -58.26 6.04 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.23 -0.919 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.6 tt -51.63 -39.5 58.2 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.22 -0.925 . . . . 0.0 110.241 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 1.02 HD23 ' O ' ' A' ' 130' ' ' LEU . 2.9 mm? . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 110.182 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.174 0.512 . . . . 0.0 110.305 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.76 ' HA ' HD13 ' A' ' 46' ' ' LEU . . . -64.67 -44.52 90.1 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.266 -0.896 . . . . 0.0 110.178 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.402 ' HG3' HG12 ' A' ' 22' ' ' ILE . 11.1 pt-20 -55.52 -42.87 75.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.177 -0.952 . . . . 0.0 110.292 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.402 HG12 ' HG3' ' A' ' 21' ' ' GLU . 25.1 mm -63.68 -53.87 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.288 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HB3' HG13 ' A' ' 43' ' ' ILE . 28.7 mmtm -50.74 -58.97 4.62 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.207 -0.933 . . . . 0.0 110.349 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.91 HG21 ' HA ' ' A' ' 56' ' ' ILE . 38.2 t -45.0 -44.52 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.0 110.447 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -38.64 91.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.118 -0.989 . . . . 0.0 110.334 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -72.03 -20.66 61.66 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.322 -0.861 . . . . 0.0 110.055 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.758 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -86.81 -15.94 37.7 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.198 -0.939 . . . . 0.0 110.05 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.505 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 14.0 p . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.33 -0.856 . . . . 0.0 110.102 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.758 HD23 ' HB2' ' A' ' 27' ' ' ALA . 1.6 tp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.259 0.552 . . . . 0.0 110.209 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -60.68 3.41 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.221 -0.925 . . . . 0.0 110.264 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.564 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 14.1 m -46.87 -28.29 1.53 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.202 -0.936 . . . . 0.0 110.216 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HB3' ' O ' ' A' ' 39' ' ' LEU . 19.5 tp10 -71.92 -50.74 26.51 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.305 -0.872 . . . . 0.0 110.249 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.596 HG21 HD11 ' A' ' 80' ' ' LEU . 8.1 mt -54.91 -31.46 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.137 -0.977 . . . . 0.0 110.03 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.537 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.48 -53.4 16.42 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.248 -0.908 . . . . 0.0 109.547 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.523 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER -53.15 -20.88 4.28 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.02 -1.05 . . . . 0.0 109.044 179.112 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.809 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 11.0 mt -80.66 -37.16 31.4 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.522 -0.736 . . . . 0.0 110.108 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.63 HG21 HG21 ' A' ' 92' ' ' VAL . 68.8 p -53.54 -43.14 68.17 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.031 -1.043 . . . . 0.0 109.29 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.523 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 92.6 m-85 -43.57 -41.23 4.43 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.394 -0.816 . . . . 0.0 109.523 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.536 ' O ' ' N ' ' A' ' 51' ' ' VAL . 0.5 OUTLIER -74.69 93.1 2.51 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.427 -0.796 . . . . 0.0 110.247 179.459 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.532 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.42 -57.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.535 178.262 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.541 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.8 t -64.48 -65.69 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.018 -1.051 . . . . 0.0 110.359 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.809 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.84 -48.87 1.16 Allowed 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.051 -177.686 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.573 ' HA ' HD12 ' A' ' 56' ' ' ILE . 2.6 t80 -55.15 -53.32 57.46 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.198 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 58' ' ' SER . 1.1 t -57.41 -26.31 60.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.179 -0.951 . . . . 0.0 110.416 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -87.58 -20.45 26.4 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.171 -0.955 . . . . 0.0 110.492 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.91 ' HA ' HG21 ' A' ' 24' ' ' VAL . 10.8 mt -78.99 -70.09 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.192 -0.942 . . . . 0.0 110.316 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.511 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 9.6 mtp -50.92 -36.79 40.24 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.174 -0.954 . . . . 0.0 109.897 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.482 ' HB2' ' O ' ' A' ' 54' ' ' SER . 42.3 t -54.37 -59.99 3.95 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.274 -0.891 . . . . 0.0 109.761 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.42 ' HA ' ' HD3' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -58.83 -28.9 66.48 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.336 -0.852 . . . . 0.0 109.587 179.488 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.768 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -66.99 -31.65 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.458 -0.776 . . . . 0.0 109.624 179.699 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.55 ' CH2' ' HE3' ' A' ' 81' ' ' MET . 41.6 m95 -76.04 -47.41 24.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.183 -0.948 . . . . 0.0 110.191 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.42 ' HD3' ' HA ' ' A' ' 59' ' ' MET . 5.9 mttt -49.86 -61.9 1.87 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.347 -0.845 . . . . 0.0 110.393 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 20.4 mmt-85 -64.27 -19.84 65.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.244 -0.91 . . . . 0.0 110.19 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.994 ' CD2' HD11 ' A' ' 106' ' ' LEU . 3.2 mt -70.73 -20.41 62.64 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.169 -0.957 . . . . 0.0 110.332 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 . . . . . 0 C--N 1.305 -1.362 0 O-C-N 121.188 -0.945 . . . . 0.0 110.218 -179.855 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.577 ' CZ3' ' HG3' ' A' ' 72' ' ' ARG . 46.1 p-90 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.212 0.529 . . . . 0.0 110.308 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.577 ' HG3' ' CZ3' ' A' ' 71' ' ' TRP . 0.9 OUTLIER -53.75 -42.01 67.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.208 -0.933 . . . . 0.0 110.232 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -66.05 -39.81 90.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.2 -0.938 . . . . 0.0 110.244 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.73 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 9.6 t -55.49 -57.12 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.178 -0.951 . . . . 0.0 110.175 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.625 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 17.3 t80 -48.77 -66.77 0.34 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -0.924 . . . . 0.0 110.019 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.505 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.3 OUTLIER -49.22 -25.29 2.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.366 -0.834 . . . . 0.0 109.963 179.851 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.826 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -67.75 -50.71 55.82 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.278 -0.889 . . . . 0.0 110.172 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.758 ' SD ' HD21 ' A' ' 64' ' ' LEU . 3.2 mpp? -54.91 -29.79 56.83 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.358 -0.839 . . . . 0.0 110.198 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.402 ' O ' ' HB3' ' A' ' 82' ' ' GLU . 2.6 m -67.59 -53.88 24.47 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.355 -0.841 . . . . 0.0 110.527 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.768 ' CD2' HD11 ' A' ' 60' ' ' ILE . 21.0 tp -55.84 -53.33 58.04 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.224 -0.922 . . . . 0.0 110.106 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.776 ' SD ' HD21 ' A' ' 130' ' ' LEU . 0.4 OUTLIER -55.0 -24.99 26.95 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.095 -1.003 . . . . 0.0 110.446 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.687 ' HB2' HD12 ' A' ' 130' ' ' LEU . 2.8 tt0 -79.37 -59.44 2.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.066 -1.021 . . . . 0.0 110.436 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.586 ' CE1' HG21 ' A' ' 87' ' ' THR . 17.8 t80 -53.45 -31.35 45.11 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.423 -0.798 . . . . 0.0 111.013 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.823 ' CB ' HG11 ' A' ' 92' ' ' VAL . 73.9 mt -77.87 -29.98 50.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 0.0 110.638 -179.407 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.878 HD13 HD11 ' A' ' 134' ' ' LEU . 26.5 mt -64.09 -11.59 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.087 -1.008 . . . . 0.0 109.974 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -107.43 -72.35 0.72 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.27 -0.894 . . . . 0.0 110.168 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.586 HG21 ' CE1' ' A' ' 83' ' ' TYR . 12.2 t -89.16 1.3 55.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.15 -0.969 . . . . 0.0 110.189 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.613 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -91.35 28.1 8.62 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.5 OUTLIER 75.06 149.29 0.1 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.562 -0.964 . . . . 0.0 110.114 -179.822 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.74 -10.3 12.33 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.391 -0.818 . . . . 0.0 110.635 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 73.8 mtp85 -70.32 -45.82 65.46 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.059 -1.026 . . . . 0.0 109.647 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.823 HG11 ' CB ' ' A' ' 84' ' ' LEU . 96.9 t -52.56 -30.94 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 O-C-N 121.488 -0.758 . . . . 0.0 110.039 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.548 ' OG ' HD21 ' A' ' 134' ' ' LEU . 21.0 t -81.23 -37.39 28.66 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.323 -0.861 . . . . 0.0 109.884 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.409 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 24.4 mm-40 -56.61 -52.55 64.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -0.873 . . . . 0.0 109.927 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.443 ' HB3' ' SD ' ' A' ' 57' ' ' MET . 7.0 tp60 -57.26 -36.95 71.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.465 -0.772 . . . . 0.0 109.594 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.6 t -57.22 -39.64 75.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.272 -0.892 . . . . 0.0 109.651 179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -71.79 -30.3 65.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.497 -0.752 . . . . 0.0 109.66 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 61.9 mt-10 -83.94 -11.83 56.27 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.453 -0.779 . . . . 0.0 110.029 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -128.41 32.08 4.91 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.375 -0.828 . . . . 0.0 110.133 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.4 ppp? -63.9 -20.44 65.85 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.263 -0.898 . . . . 0.0 110.118 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.484 ' O ' ' HB ' ' A' ' 105' ' ' THR . 31.6 m-85 -75.97 -20.85 57.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.277 -0.889 . . . . 0.0 110.274 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.951 ' O ' HG22 ' A' ' 105' ' ' THR . . . -85.72 -39.85 16.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.155 -0.966 . . . . 0.0 110.106 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.618 HG11 HG22 ' A' ' 131' ' ' VAL . 3.6 p -73.93 -41.91 53.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.637 0 CA-C-O 122.033 0.92 . . . . 0.0 109.141 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.568 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 3.7 mm-40 -69.42 -24.51 63.85 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.68 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 102' ' ' ALA . 5.0 t -59.53 -27.77 66.48 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.953 -1.092 . . . . 0.0 109.932 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.994 HD11 ' CD2' ' A' ' 64' ' ' LEU . 61.8 mt -59.44 -37.74 78.89 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.324 -0.86 . . . . 0.0 110.144 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.413 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 34.8 ttpt . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.021 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.54 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.0 p . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 121.341 0.591 . . . . 0.0 110.149 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.54 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 15.3 m-20 -36.36 -29.1 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.877 -0.514 . . . . 0.0 111.022 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.606 HG13 ' CG1' ' A' ' 74' ' ' VAL . 12.0 t -73.72 -64.72 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.122 -0.986 . . . . 0.0 110.358 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.413 ' HG3' ' HA ' ' A' ' 107' ' ' LYS . 35.5 ttp180 -51.96 -31.25 28.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.256 -0.902 . . . . 0.0 110.77 -179.525 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.467 ' HG3' HG22 ' A' ' 121' ' ' VAL . 11.5 mt-10 -76.31 -46.98 25.25 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.173 -0.955 . . . . 0.0 110.617 -179.631 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.625 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -55.43 -49.71 71.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.99 . . . . 0.0 110.257 -179.763 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.564 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -66.33 -41.31 89.78 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.305 -0.872 . . . . 0.0 110.712 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -34.25 73.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.178 -0.951 . . . . 0.0 110.762 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -77.67 -28.54 51.17 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.183 -0.948 . . . . 0.0 110.861 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.776 HD21 ' SD ' ' A' ' 81' ' ' MET . 5.1 tt -68.74 -48.0 64.89 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.134 -0.979 . . . . 0.0 110.282 -179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.618 HG22 HG11 ' A' ' 103' ' ' VAL . 5.3 t -69.4 -28.18 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.261 -0.899 . . . . 0.0 110.137 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.48 -47.12 57.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.852 . . . . 0.0 110.432 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.98 -33.56 70.82 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.18 -0.95 . . . . 0.0 110.4 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.878 HD11 HD13 ' A' ' 85' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.168 -0.958 . . . . 0.0 110.425 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.429 ' O ' ' HB ' ' A' ' 22' ' ' ILE . 50.7 mt-10 . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.23 0.538 . . . . 0.0 110.491 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.785 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -56.86 -54.59 44.71 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.156 -0.965 . . . . 0.0 110.129 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' A' ' 20' ' ' ALA . 5.7 pt-20 -43.75 -26.49 0.25 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.095 -1.003 . . . . 0.0 109.975 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 19' ' ' GLU . 21.5 mm -77.72 -49.01 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.293 -0.879 . . . . 0.0 110.074 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.67 -42.94 75.83 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.296 -0.878 . . . . 0.0 110.138 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.717 HG13 ' CD2' ' A' ' 80' ' ' LEU . 78.4 t -65.43 -41.96 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.249 -0.907 . . . . 0.0 110.048 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -50.42 -44.86 55.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.197 -0.939 . . . . 0.0 110.159 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -79.04 -26.98 43.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.382 -0.824 . . . . 0.0 110.188 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.795 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -64.42 -23.06 67.16 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.166 -0.959 . . . . 0.0 110.197 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.4 p . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 110.178 179.979 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.795 HD21 ' HB2' ' A' ' 27' ' ' ALA . 1.1 tp . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.304 0.573 . . . . 0.0 110.122 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 3.9 mtm -70.11 -43.42 71.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.193 -0.942 . . . . 0.0 110.152 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.44 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 0.1 OUTLIER -60.6 -35.56 76.42 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.286 -0.884 . . . . 0.0 110.129 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -73.51 -39.55 64.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.274 -0.891 . . . . 0.0 110.121 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.792 HG21 HD11 ' A' ' 80' ' ' LEU . 67.8 mt -64.79 -33.15 61.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 0.0 109.968 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.631 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -74.58 -48.64 25.51 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.213 -0.929 . . . . 0.0 108.956 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.402 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 6.3 m-20 -52.7 -23.03 5.89 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.785 HD22 ' HB2' ' A' ' 20' ' ' ALA . 9.9 mt -77.3 -39.57 47.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.831 -0.543 . . . . 0.0 109.942 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.537 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 81.0 p -48.79 -42.85 37.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.103 -0.998 . . . . 0.0 109.037 179.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.579 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 75.3 m-85 -45.05 -47.66 11.79 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.196 -0.94 . . . . 0.0 109.199 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.533 ' O ' ' C ' ' A' ' 50' ' ' VAL . 2.3 m-80 -66.88 89.83 0.17 Allowed 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.46 0.648 . . . . 0.0 110.421 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.533 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.19 -59.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.681 178.331 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.542 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.7 t -64.57 -65.09 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.157 -0.964 . . . . 0.0 110.424 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.622 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -36.52 -43.63 0.4 Allowed 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.149 0.5 . . . . 0.0 111.173 -177.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.623 ' HA ' HD12 ' A' ' 56' ' ' ILE . 6.5 t80 -58.99 -58.11 10.1 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.242 -0.911 . . . . 0.0 110.454 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.8 t -51.42 -36.0 41.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.258 -0.901 . . . . 0.0 110.46 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.9 -28.9 60.82 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.304 -0.873 . . . . 0.0 110.402 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.686 HD11 ' HB3' ' A' ' 46' ' ' LEU . 22.2 mt -73.03 -70.01 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -0.89 . . . . 0.0 110.472 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.54 ' HE1' ' CZ2' ' A' ' 61' ' ' TRP . 65.2 mmm -46.14 -36.35 5.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.096 -1.003 . . . . 0.0 110.021 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.5 m -53.83 -63.84 1.02 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.325 -0.86 . . . . 0.0 110.197 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -31.44 64.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.066 -1.021 . . . . 0.0 109.478 179.696 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.668 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.8 OUTLIER -63.15 -34.12 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.467 -0.771 . . . . 0.0 109.852 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.54 ' CZ2' ' HE1' ' A' ' 57' ' ' MET . 34.6 m95 -78.15 -29.33 48.65 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.186 -0.946 . . . . 0.0 110.186 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -58.74 7.09 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.243 -0.911 . . . . 0.0 110.197 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.484 ' HB3' ' HB3' ' A' ' 73' ' ' HIS . 2.8 mtt180 -71.04 -15.62 62.56 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.279 -0.888 . . . . 0.0 110.127 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.696 HD22 HD11 ' A' ' 106' ' ' LEU . 13.5 mt -80.73 -8.33 59.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.354 -0.841 . . . . 0.0 110.581 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.238 -0.914 . . . . 0.0 111.223 -179.321 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.524 ' CH2' ' HG2' ' A' ' 72' ' ' ARG . 44.0 p-90 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.245 0.545 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.524 ' HG2' ' CH2' ' A' ' 71' ' ' TRP . 38.7 mtt180 -49.24 -48.04 46.02 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.217 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 63' ' ' ARG . 30.1 m170 -54.19 -47.75 71.72 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.267 -0.896 . . . . 0.0 110.176 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.724 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 47.1 t -47.96 -50.4 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.257 -0.902 . . . . 0.0 110.206 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -52.6 -61.36 2.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.225 -0.922 . . . . 0.0 109.94 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.472 ' HE2' ' O ' ' A' ' 72' ' ' ARG . 8.5 mtmm -52.32 -23.17 5.4 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.239 -0.913 . . . . 0.0 109.476 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' A' ' 74' ' ' VAL . . . -70.91 -46.54 62.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.344 -0.848 . . . . 0.0 109.909 179.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.766 ' HE2' HG23 ' A' ' 123' ' ' VAL . 0.1 OUTLIER -53.19 -37.62 62.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.451 -0.781 . . . . 0.0 109.967 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.483 ' O ' ' HB3' ' A' ' 82' ' ' GLU . 1.9 m -62.86 -63.09 1.31 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.191 -0.943 . . . . 0.0 110.15 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.792 HD11 HG21 ' A' ' 43' ' ' ILE . 15.3 tp -44.86 -69.55 0.13 Allowed 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.199 -0.938 . . . . 0.0 109.39 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.551 ' HE2' HD11 ' A' ' 64' ' ' LEU . 6.5 ttp -39.09 -35.96 0.27 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.495 -0.753 . . . . 0.0 110.811 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.843 ' HB2' HD11 ' A' ' 130' ' ' LEU . 1.6 tm-20 -69.54 -66.16 0.62 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.011 -1.056 . . . . 0.0 110.247 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.559 ' CE1' HG21 ' A' ' 87' ' ' THR . 24.1 t80 -41.76 -48.81 4.32 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.237 -0.914 . . . . 0.0 110.841 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.746 HD11 HD11 ' A' ' 80' ' ' LEU . 7.5 mt -59.85 -48.48 81.52 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.084 -1.01 . . . . 0.0 110.278 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.664 HD12 HD21 ' A' ' 130' ' ' LEU . 76.0 mt -55.08 -23.37 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.189 -0.945 . . . . 0.0 110.008 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -87.73 -77.44 0.35 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.24 -0.912 . . . . 0.0 110.146 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.559 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.9 t -89.64 -20.56 23.54 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 110.258 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.631 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -43.74 -73.93 0.23 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.3 OUTLIER 172.32 175.09 0.09 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.194 -1.18 . . . . 0.0 110.223 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 25.8 mt-10 -73.65 -16.81 61.21 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.235 -0.916 . . . . 0.0 110.168 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -76.57 -35.09 58.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.252 -0.905 . . . . 0.0 110.05 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.555 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 69.9 t -63.06 -51.92 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.211 -0.931 . . . . 0.0 110.053 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 p -61.37 -43.2 99.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.199 -0.938 . . . . 0.0 109.993 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.466 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 6.4 mm-40 -53.18 -49.45 66.67 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.229 -0.919 . . . . 0.0 109.815 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.466 ' OE1' ' CB ' ' A' ' 57' ' ' MET . 5.2 tt0 -55.35 -44.01 75.57 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.489 -0.757 . . . . 0.0 109.62 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -43.21 62.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.336 -0.853 . . . . 0.0 109.432 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -66.73 -35.36 79.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.752 . . . . 0.0 109.829 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 19.7 mt-10 -78.62 -11.06 59.95 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.362 -0.836 . . . . 0.0 109.887 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -136.21 38.45 2.73 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.356 -0.84 . . . . 0.0 110.068 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 3.5 mtp -62.76 -33.29 74.85 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.286 -0.884 . . . . 0.0 110.221 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.459 ' O ' ' HB ' ' A' ' 105' ' ' THR . 4.2 m-30 -59.99 -21.12 60.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.322 -0.861 . . . . 0.0 110.039 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.9 ' O ' HG22 ' A' ' 105' ' ' THR . . . -81.87 -42.68 19.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.347 -0.845 . . . . 0.0 110.139 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.563 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.5 t -75.22 -19.59 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.38 -0.825 . . . . 0.0 109.927 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -91.89 -32.17 15.4 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.291 -0.881 . . . . 0.0 110.115 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.9 HG22 ' O ' ' A' ' 102' ' ' ALA . 14.7 t -58.15 -23.82 56.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.314 -0.866 . . . . 0.0 109.873 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.696 HD11 HD22 ' A' ' 64' ' ' LEU . 11.4 mt -69.19 -41.07 77.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.319 -0.863 . . . . 0.0 110.041 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 6.2 ttpp . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.337 -0.852 . . . . 0.0 110.258 179.959 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.558 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.5 p . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 121.4 0.619 . . . . 0.0 109.93 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.558 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.5 OUTLIER -45.18 -49.8 11.85 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.421 -0.799 . . . . 0.0 110.104 179.868 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.766 HG23 ' HE2' ' A' ' 78' ' ' MET . 7.1 p -59.49 -37.51 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 0.0 110.384 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.485 ' N ' HG13 ' A' ' 123' ' ' VAL . 14.8 mtm180 -62.75 -68.11 0.36 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.21 -0.931 . . . . 0.0 110.789 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 122' ' ' ASN . 0.0 OUTLIER -52.51 -33.26 44.26 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.311 -0.868 . . . . 0.0 110.96 -179.321 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 0.7 OUTLIER -59.56 -55.23 37.18 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.938 -1.101 . . . . 0.0 110.175 -179.937 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.563 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -53.89 -41.32 67.46 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.235 -0.915 . . . . 0.0 110.44 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.75 -35.66 75.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.247 -0.908 . . . . 0.0 110.421 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -66.72 -50.9 61.29 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.246 -0.909 . . . . 0.0 110.43 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.843 HD11 ' HB2' ' A' ' 82' ' ' GLU . 0.2 OUTLIER -54.11 -29.63 45.6 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.209 -0.932 . . . . 0.0 110.156 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 85.6 t -83.33 -29.6 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.307 -0.871 . . . . 0.0 110.224 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.4 -50.9 41.65 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.354 -0.842 . . . . 0.0 110.402 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.583 HD13 ' O ' ' A' ' 133' ' ' LEU . 0.8 OUTLIER -63.31 -51.44 66.0 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.211 -0.93 . . . . 0.0 110.382 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.704 HD13 ' O ' ' A' ' 130' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.178 -0.951 . . . . 0.0 110.301 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.228 0.537 . . . . 0.0 110.502 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.949 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -66.71 -48.59 68.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.096 -1.002 . . . . 0.0 110.236 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.452 ' HG3' HG13 ' A' ' 22' ' ' ILE . 24.4 pt-20 -43.55 -34.71 1.46 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.105 -0.997 . . . . 0.0 110.153 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.452 HG13 ' HG3' ' A' ' 21' ' ' GLU . 67.4 mt -74.53 -41.19 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.27 -0.894 . . . . 0.0 110.108 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -59.79 -46.5 88.99 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.225 -0.922 . . . . 0.0 110.193 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.919 HG22 HD21 ' A' ' 80' ' ' LEU . 16.8 t -60.27 -35.92 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.232 -0.917 . . . . 0.0 110.1 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -35.69 80.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.232 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -77.17 -34.8 56.33 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.238 -0.914 . . . . 0.0 110.085 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.7 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -63.66 -24.13 67.66 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.29 -0.881 . . . . 0.0 110.119 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.518 HG22 ' O ' ' A' ' 76' ' ' LYS . 56.2 p . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.222 -0.923 . . . . 0.0 110.088 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.7 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.14 0.495 . . . . 0.0 110.255 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 16.6 mtt -62.23 -62.16 1.96 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.271 -0.893 . . . . 0.0 110.242 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.439 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 50.0 m -53.97 -18.53 3.59 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.317 -0.865 . . . . 0.0 110.322 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -57.75 3.59 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 0.0 110.423 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.873 HG21 HD11 ' A' ' 80' ' ' LEU . 4.1 mt -48.34 -30.68 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.144 -0.973 . . . . 0.0 110.143 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.524 ' HA ' HD22 ' A' ' 84' ' ' LEU . . . -71.28 -56.04 6.82 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.095 -1.003 . . . . 0.0 109.558 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.462 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 12.1 t0 -49.98 -24.37 2.55 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.944 -1.098 . . . . 0.0 108.83 179.096 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.949 HD22 ' HB2' ' A' ' 20' ' ' ALA . 2.5 mt -74.04 -43.01 59.4 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.623 -0.673 . . . . 0.0 109.965 179.399 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.548 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 70.7 p -48.49 -42.97 34.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.163 -0.961 . . . . 0.0 109.324 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.568 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 79.8 m-85 -46.2 -47.48 17.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.261 -0.9 . . . . 0.0 109.237 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.549 ' O ' ' C ' ' A' ' 50' ' ' VAL . 1.1 t30 -68.74 91.34 0.44 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.549 -0.72 . . . . 0.0 110.434 179.558 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.549 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.65 -59.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.159 177.954 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.533 ' H ' HG13 ' A' ' 50' ' ' VAL . 2.6 t -62.65 -64.39 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.033 -1.042 . . . . 0.0 110.076 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.817 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -36.18 -48.09 0.6 Allowed 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.891 -177.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.548 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 13.9 t80 -57.67 -54.17 49.87 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.278 -0.889 . . . . 0.0 110.069 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.8 t -54.5 -24.6 21.2 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.298 -0.876 . . . . 0.0 110.042 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 51' ' ' VAL . 14.4 mm-40 -86.14 -28.02 24.24 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.283 -0.886 . . . . 0.0 109.973 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.858 HD11 ' HB3' ' A' ' 46' ' ' LEU . 6.4 mt -80.67 -70.31 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.345 -0.847 . . . . 0.0 110.147 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.445 ' HG2' ' HG2' ' A' ' 95' ' ' GLN . 0.9 OUTLIER -46.22 -39.42 9.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.322 -0.861 . . . . 0.0 110.031 179.766 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.4 m -56.44 -58.83 6.34 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.288 -0.882 . . . . 0.0 110.062 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 18.9 mmt -63.01 -15.93 58.08 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.253 -0.905 . . . . 0.0 109.968 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.787 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -81.31 -31.4 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 109.653 179.751 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.597 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 11.1 m95 -75.07 -46.13 36.84 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.287 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.47 ' HA ' ' OD1' ' A' ' 65' ' ' ASN . 11.4 mtpt -59.56 -53.18 61.01 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.278 -0.889 . . . . 0.0 109.981 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 85.8 mmt-85 -65.81 -9.63 30.36 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -0.884 . . . . 0.0 109.954 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.799 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 7.0 mt -88.53 -20.63 24.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.35 -0.844 . . . . 0.0 110.44 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.505 ' ND2' ' O ' ' A' ' 65' ' ' ASN . 2.4 p-10 . . . . . 0 C--N 1.302 -1.473 0 O-C-N 121.202 -0.936 . . . . 0.0 110.351 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.422 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 65.6 p-90 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.193 0.52 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.36 -38.02 18.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.235 -0.916 . . . . 0.0 109.935 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.405 ' ND1' ' N ' ' A' ' 73' ' ' HIS . 2.5 m-70 -61.8 -41.33 97.61 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.353 -0.842 . . . . 0.0 109.861 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.599 HG12 HG22 ' A' ' 123' ' ' VAL . 28.7 t -58.08 -52.34 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.481 -0.762 . . . . 0.0 110.076 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.448 ' HB2' HG23 ' A' ' 123' ' ' VAL . 8.5 t80 -49.92 -53.18 27.68 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.335 -0.853 . . . . 0.0 110.15 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.518 ' O ' HG22 ' A' ' 28' ' ' THR . 4.9 mmtt -64.03 -25.55 68.17 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.246 -0.909 . . . . 0.0 110.107 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.799 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -73.38 -23.83 60.23 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.262 -0.899 . . . . 0.0 110.026 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.599 ' SD ' HD13 ' A' ' 106' ' ' LEU . 0.7 OUTLIER -77.12 -41.42 42.03 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.232 -0.917 . . . . 0.0 109.815 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.5 m -58.03 -55.7 31.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.463 -0.773 . . . . 0.0 110.062 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.919 HD21 HG22 ' A' ' 24' ' ' VAL . 31.8 tp -50.84 -57.63 7.98 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.367 -0.833 . . . . 0.0 109.784 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.597 ' HE1' ' CZ3' ' A' ' 61' ' ' TRP . 1.8 ttp -47.29 -32.57 4.8 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.244 -0.91 . . . . 0.0 110.225 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.419 ' O ' ' C ' ' A' ' 83' ' ' TYR . 0.8 OUTLIER -75.17 -68.21 0.58 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.192 -0.943 . . . . 0.0 110.589 -179.908 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.465 ' O ' HG22 ' A' ' 87' ' ' THR . 48.7 t80 -40.33 -37.25 0.64 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 111.027 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.544 ' C ' HG11 ' A' ' 92' ' ' VAL . 52.7 mt -76.09 -40.18 53.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.175 -0.953 . . . . 0.0 110.548 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.884 HG21 HD11 ' A' ' 134' ' ' LEU . 20.4 mt -53.47 -27.41 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 120.974 -1.079 . . . . 0.0 110.186 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.82 -74.78 0.49 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.121 -0.987 . . . . 0.0 110.422 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.496 HG23 ' HB1' ' A' ' 44' ' ' ALA . 11.2 t -86.06 -22.31 27.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.251 -0.905 . . . . 0.0 110.336 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.568 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -43.87 -74.06 0.22 Allowed Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 3.1 t 172.25 160.75 0.11 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.151 -1.205 . . . . 0.0 110.293 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.07 -19.5 32.26 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.27 -0.894 . . . . 0.0 110.087 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -76.52 -38.12 55.65 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.273 -0.892 . . . . 0.0 110.187 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.544 HG11 ' C ' ' A' ' 84' ' ' LEU . 71.6 t -60.01 -28.07 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.291 -0.881 . . . . 0.0 110.084 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.4 p -86.06 -38.54 17.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.234 -0.916 . . . . 0.0 110.162 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -58.84 -57.49 12.8 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.292 -0.88 . . . . 0.0 109.98 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.445 ' HG2' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -52.75 -35.74 56.72 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.4 -0.813 . . . . 0.0 109.875 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.495 ' O ' ' N ' ' A' ' 100' ' ' MET . 0.7 OUTLIER -59.55 -43.42 93.54 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.328 -0.858 . . . . 0.0 109.778 179.587 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -66.6 -35.93 81.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.322 179.286 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -80.84 -10.05 59.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.498 -0.752 . . . . 0.0 109.721 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -135.64 26.87 3.38 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.43 -0.794 . . . . 0.0 109.848 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' MET . . . . . 0.495 ' N ' ' O ' ' A' ' 96' ' ' CYS . 0.2 OUTLIER -61.53 -29.83 70.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.354 -0.841 . . . . 0.0 109.917 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -57.82 -27.31 63.03 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.329 -0.857 . . . . 0.0 109.816 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.774 ' O ' HG22 ' A' ' 105' ' ' THR . . . -72.13 -41.52 67.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.41 -0.806 . . . . 0.0 110.043 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.463 ' CG1' HG23 ' A' ' 131' ' ' VAL . 3.3 t -76.9 -19.92 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.364 -0.835 . . . . 0.0 109.946 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.612 ' HG2' HG21 ' A' ' 131' ' ' VAL . 1.1 mt-30 -91.28 -23.75 20.06 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.276 -0.89 . . . . 0.0 110.124 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.774 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.7 t -75.85 -24.31 55.76 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.252 -0.905 . . . . 0.0 110.098 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.754 HD11 HD22 ' A' ' 64' ' ' LEU . 10.0 mt -61.05 -42.67 98.92 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.262 -0.899 . . . . 0.0 109.967 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.513 ' HA ' ' CA ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.198 -0.939 . . . . 0.0 110.014 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.594 HG12 ' N ' ' A' ' 122' ' ' ASN . 6.6 t . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 121.054 0.454 . . . . 0.0 111.031 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.594 ' N ' HG12 ' A' ' 121' ' ' VAL . 16.2 m-80 -33.63 -33.54 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.766 -0.583 . . . . 0.0 111.197 -178.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.599 HG22 HG12 ' A' ' 74' ' ' VAL . 1.7 t -77.58 -49.2 22.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.916 -1.115 . . . . 0.0 109.703 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.513 ' CA ' ' HA ' ' A' ' 107' ' ' LYS . 10.9 mtm-85 -60.79 -56.6 19.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.109 -0.995 . . . . 0.0 110.732 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -62.1 -51.11 69.22 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.271 -0.893 . . . . 0.0 110.956 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 122' ' ' ASN . 0.6 OUTLIER -50.43 -48.32 56.31 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.012 -1.055 . . . . 0.0 110.255 -179.688 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -55.19 -46.04 75.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.36 -0.838 . . . . 0.0 110.591 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -62.12 -35.48 78.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.115 -0.991 . . . . 0.0 110.414 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -60.36 -51.48 69.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -0.913 . . . . 0.0 110.555 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.76 HD21 ' CD1' ' A' ' 85' ' ' ILE . 2.1 tt -53.9 -36.76 63.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.14 -0.975 . . . . 0.0 110.295 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.612 HG21 ' HG2' ' A' ' 104' ' ' GLN . 76.5 t -74.87 -27.1 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.353 -0.842 . . . . 0.0 110.144 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.42 -51.5 43.16 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.374 -0.829 . . . . 0.0 110.576 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.58 HD11 HD12 ' A' ' 134' ' ' LEU . 2.2 pp -63.83 -26.04 68.44 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.202 -0.936 . . . . 0.0 110.384 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.884 HD11 HG21 ' A' ' 85' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.666 0 O-C-N 121.268 -0.895 . . . . 0.0 110.106 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.227 0.537 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.76 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -67.85 -50.14 58.26 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.184 -0.947 . . . . 0.0 110.141 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HG3' HG13 ' A' ' 22' ' ' ILE . 16.7 pt-20 -49.21 -29.68 5.97 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.22 -0.925 . . . . 0.0 110.205 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.465 HG13 ' HG3' ' A' ' 21' ' ' GLU . 55.8 mt -74.71 -39.89 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.206 -0.934 . . . . 0.0 110.011 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.675 ' O ' HD11 ' A' ' 43' ' ' ILE . 14.7 mttp -70.66 -23.99 62.61 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.383 -0.823 . . . . 0.0 110.073 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.744 HG21 ' HA ' ' A' ' 56' ' ' ILE . 72.3 t -79.55 -34.1 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.249 -0.907 . . . . 0.0 110.152 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -40.38 87.73 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.296 -0.877 . . . . 0.0 110.263 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -44.12 54.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.335 -0.853 . . . . 0.0 110.176 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.631 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -57.06 -20.55 25.59 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.242 -0.911 . . . . 0.0 110.114 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.546 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 2.5 p . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.214 -0.929 . . . . 0.0 110.077 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.631 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 13.1 tp . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.266 0.555 . . . . 0.0 110.333 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.09 -42.61 99.65 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.15 -0.969 . . . . 0.0 110.316 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.422 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.3 OUTLIER -61.53 -33.46 73.86 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.118 -0.989 . . . . 0.0 110.193 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.08 -44.23 60.79 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.195 -0.94 . . . . 0.0 110.0 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.726 HG21 HD11 ' A' ' 80' ' ' LEU . 85.4 mt -59.64 -31.34 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.192 -0.942 . . . . 0.0 110.021 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.731 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -72.58 -52.79 14.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.924 . . . . 0.0 109.522 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.465 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 27.9 t0 -51.52 -22.39 3.14 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.988 -1.07 . . . . 0.0 108.679 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.76 HD13 ' CB ' ' A' ' 20' ' ' ALA . 15.1 mt -77.68 -40.64 40.8 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.593 -0.692 . . . . 0.0 109.908 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.52 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 68.0 p -49.64 -42.95 46.4 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.154 -0.967 . . . . 0.0 109.407 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.545 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 85.3 m-85 -44.88 -45.37 10.25 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.241 -0.912 . . . . 0.0 109.486 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.534 ' O ' ' N ' ' A' ' 51' ' ' VAL . 3.4 t-20 -71.47 92.65 1.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.511 -0.743 . . . . 0.0 110.331 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.523 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.75 -56.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.863 178.301 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.54 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.8 t -64.21 -65.7 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 120.954 -1.091 . . . . 0.0 110.495 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.684 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.51 -45.01 0.7 Allowed 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 121.169 0.509 . . . . 0.0 110.972 -177.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.585 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 16.7 t80 -60.19 -53.82 53.14 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.32 -0.862 . . . . 0.0 110.425 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' A' ' 58' ' ' SER . 9.2 t -56.62 -21.07 24.46 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.221 -0.924 . . . . 0.0 110.152 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -93.75 -22.46 18.69 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -0.894 . . . . 0.0 110.368 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.744 ' HA ' HG21 ' A' ' 24' ' ' VAL . 30.1 mt -81.67 -55.95 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.242 -0.911 . . . . 0.0 110.203 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.602 ' HE2' ' HG2' ' A' ' 95' ' ' GLN . 90.8 mmm -58.6 -36.12 73.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.196 -0.94 . . . . 0.0 109.705 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' ' 54' ' ' SER . 0.3 OUTLIER -59.02 -55.3 36.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.332 -0.855 . . . . 0.0 109.801 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.554 ' HB2' HG11 ' A' ' 24' ' ' VAL . 3.0 mmt -63.29 -25.08 68.15 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.225 -0.922 . . . . 0.0 109.766 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.685 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -73.67 -31.0 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.519 -0.738 . . . . 0.0 109.824 179.817 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.508 ' CZ2' ' HE1' ' A' ' 81' ' ' MET . 16.4 m95 -76.39 -56.99 4.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.127 -0.983 . . . . 0.0 110.143 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.13 -50.84 10.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.247 -0.908 . . . . 0.0 110.214 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -68.38 -31.87 71.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.212 -0.93 . . . . 0.0 110.151 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.793 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 7.4 mt -65.25 -26.82 68.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.29 -0.882 . . . . 0.0 110.054 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 C--N 1.302 -1.457 0 O-C-N 121.338 -0.851 . . . . 0.0 109.933 -179.887 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.408 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 51.2 p-90 . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.269 0.557 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.54 -37.74 58.29 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.264 -0.897 . . . . 0.0 110.215 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -68.04 -32.03 72.11 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.303 -0.873 . . . . 0.0 110.204 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.677 HG12 ' HE2' ' A' ' 78' ' ' MET . 27.1 t -64.71 -59.4 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.196 -0.94 . . . . 0.0 110.2 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -47.02 -53.42 12.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.266 -0.896 . . . . 0.0 109.936 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.546 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -59.27 -33.07 70.61 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.239 -0.913 . . . . 0.0 109.63 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.793 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -66.71 -28.85 68.76 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.287 -0.883 . . . . 0.0 109.645 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.677 ' HE2' HG12 ' A' ' 74' ' ' VAL . 1.8 mtt -71.0 -32.92 69.86 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.282 -0.886 . . . . 0.0 109.923 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.0 m -67.87 -37.1 81.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.326 -0.859 . . . . 0.0 110.307 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.726 HD11 HG21 ' A' ' 43' ' ' ILE . 23.1 tp -73.06 -37.85 66.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.213 -0.929 . . . . 0.0 110.022 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.613 ' HG2' HD21 ' A' ' 130' ' ' LEU . 3.2 ttt -73.61 -27.0 61.06 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.173 -0.955 . . . . 0.0 109.946 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.5 ' HG3' HD12 ' A' ' 130' ' ' LEU . 1.8 tt0 -80.05 -37.67 33.5 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 110.015 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.422 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 37.1 t80 -72.7 -46.06 55.64 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.386 -0.821 . . . . 0.0 110.349 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.731 HD23 ' HB2' ' A' ' 44' ' ' ALA . 76.3 mt -66.63 -43.54 84.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.266 -0.896 . . . . 0.0 110.34 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.66 HD13 HD11 ' A' ' 134' ' ' LEU . 8.6 mt -53.41 -19.32 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.107 -0.996 . . . . 0.0 109.681 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -96.22 -79.32 0.45 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.272 -0.893 . . . . 0.0 110.18 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 88' ' ' GLY . 10.2 t -80.08 -23.63 41.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.221 -0.924 . . . . 0.0 110.288 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.56 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -43.97 -71.11 0.48 Allowed Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.466 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.6 OUTLIER 171.78 160.59 0.1 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.203 -1.175 . . . . 0.0 110.174 179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -59.61 -16.17 23.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.219 -0.925 . . . . 0.0 110.093 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.0 mmt180 -79.79 -40.97 27.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.281 -0.887 . . . . 0.0 110.323 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.458 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 53.1 t -57.91 -38.17 64.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.151 -0.968 . . . . 0.0 109.933 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.2 m -71.49 -42.69 67.73 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.177 -0.952 . . . . 0.0 109.779 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -56.13 -39.73 72.7 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.287 -0.883 . . . . 0.0 109.777 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.602 ' HG2' ' HE2' ' A' ' 57' ' ' MET . 3.9 tt0 -68.64 -38.02 80.17 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.376 -0.827 . . . . 0.0 109.296 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.681 ' SG ' HD22 ' A' ' 134' ' ' LEU . 51.8 t -58.1 -28.62 64.78 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.028 -1.045 . . . . 0.0 108.807 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -87.2 -20.99 26.15 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.519 -0.738 . . . . 0.0 110.04 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.1 pt-20 -84.52 -20.01 32.3 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.104 -0.998 . . . . 0.0 109.932 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -124.7 44.49 2.76 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.394 -0.816 . . . . 0.0 110.099 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.12 -34.73 76.9 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.247 -0.908 . . . . 0.0 110.106 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -59.94 -21.44 61.17 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.362 -0.836 . . . . 0.0 110.01 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.756 ' O ' HG22 ' A' ' 105' ' ' THR . . . -82.46 -42.39 18.57 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.327 -0.858 . . . . 0.0 110.292 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.555 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.6 t -75.06 -18.82 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.325 -0.859 . . . . 0.0 110.268 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.501 ' HG2' HG21 ' A' ' 131' ' ' VAL . 0.2 OUTLIER -95.33 -27.77 15.3 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.212 -0.93 . . . . 0.0 110.649 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.756 HG22 ' O ' ' A' ' 102' ' ' ALA . 9.7 t -64.95 -14.67 60.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.089 -1.007 . . . . 0.0 110.094 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.723 HD11 HD22 ' A' ' 64' ' ' LEU . 8.9 mt -65.26 -34.23 77.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.356 -0.84 . . . . 0.0 110.197 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.343 -0.848 . . . . 0.0 110.428 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.546 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.443 0.64 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.546 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.6 OUTLIER -49.08 -50.96 34.32 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.488 -0.758 . . . . 0.0 110.007 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.598 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 6.4 p -74.24 -20.61 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.072 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.457 ' HB3' ' O ' ' A' ' 121' ' ' VAL . 9.9 ttt180 -68.29 -65.29 0.72 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.153 -0.967 . . . . 0.0 110.392 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -62.07 -28.92 69.95 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.382 -0.824 . . . . 0.0 110.47 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -58.55 7.95 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.063 -1.023 . . . . 0.0 110.082 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -51.87 -40.27 60.35 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.202 -0.936 . . . . 0.0 110.0 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -63.36 -36.85 85.09 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.282 -0.886 . . . . 0.0 110.375 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.49 -49.81 73.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.253 -0.904 . . . . 0.0 110.404 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.613 HD21 ' HG2' ' A' ' 81' ' ' MET . 0.9 OUTLIER -56.98 -28.84 62.73 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.963 -1.086 . . . . 0.0 109.654 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.501 HG21 ' HG2' ' A' ' 104' ' ' GLN . 55.7 t -78.53 -27.78 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.282 -0.886 . . . . 0.0 109.728 179.524 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -75.61 -57.41 3.9 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.378 -0.826 . . . . 0.0 110.374 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.95 -34.85 4.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.218 -0.926 . . . . 0.0 110.446 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.681 HD22 ' SG ' ' A' ' 96' ' ' CYS . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 O-C-N 121.134 -0.979 . . . . 0.0 110.394 -179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.16 0.505 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.617 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -58.42 -50.34 74.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.152 -0.968 . . . . 0.0 110.133 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' A' ' 20' ' ' ALA . 8.0 pt-20 -43.23 -29.64 0.41 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.27 -0.893 . . . . 0.0 110.08 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.7 mt -82.59 -43.13 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.238 -0.914 . . . . 0.0 110.073 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.624 ' O ' HD11 ' A' ' 43' ' ' ILE . 8.0 mmtm -57.11 -32.34 66.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.311 -0.868 . . . . 0.0 110.111 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.965 HG13 ' CD2' ' A' ' 80' ' ' LEU . 87.0 t -76.34 -43.6 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.986 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.18 -39.22 74.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.316 -0.865 . . . . 0.0 110.126 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -83.18 -29.48 28.53 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.393 -0.817 . . . . 0.0 110.154 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.893 ' HB2' HD12 ' A' ' 39' ' ' LEU . . . -62.14 -25.05 67.52 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.299 -0.876 . . . . 0.0 110.014 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.501 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 28.3 p . . . . . 0 N--CA 1.489 1.508 0 O-C-N 121.259 -0.901 . . . . 0.0 110.111 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.893 HD12 ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.206 0.527 . . . . 0.0 110.318 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.2 mmm -75.84 -60.67 2.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.235 -0.916 . . . . 0.0 110.464 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 86.0 p -48.93 -29.33 4.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.167 -0.958 . . . . 0.0 110.366 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -74.36 -53.5 9.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.264 -0.897 . . . . 0.0 110.403 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.843 HG21 HD11 ' A' ' 80' ' ' LEU . 44.4 mt -53.52 -39.62 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -0.925 . . . . 0.0 110.112 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.702 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -66.36 -51.08 60.78 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.076 -1.015 . . . . 0.0 109.168 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.48 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -56.22 -19.33 13.37 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.088 -1.008 . . . . 0.0 108.862 178.874 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.705 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 13.5 mt -82.76 -38.53 23.08 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.572 -0.705 . . . . 0.0 110.092 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.591 HG21 HG21 ' A' ' 92' ' ' VAL . 61.7 p -51.75 -43.28 62.86 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.078 -1.014 . . . . 0.0 109.223 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.48 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 88.3 m-85 -43.18 -43.41 4.64 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.475 -0.765 . . . . 0.0 109.485 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.543 ' O ' ' N ' ' A' ' 51' ' ' VAL . 2.6 t-20 -73.17 93.44 1.84 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.558 -0.714 . . . . 0.0 110.328 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.519 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.95 -56.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.908 178.37 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.543 ' N ' ' O ' ' A' ' 49' ' ' ASN . 3.1 t -66.19 -66.29 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.044 -1.035 . . . . 0.0 110.701 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.705 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.64 -46.09 0.84 Allowed 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.022 -177.615 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.532 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 3.1 t80 -56.44 -53.91 51.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.29 -0.881 . . . . 0.0 110.037 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.2 m -57.18 -21.83 36.09 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.144 -0.973 . . . . 0.0 110.025 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -88.95 -24.64 22.38 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.357 -0.839 . . . . 0.0 110.189 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.758 HG12 HG23 ' A' ' 43' ' ' ILE . 4.1 mt -79.15 -70.32 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.405 -0.809 . . . . 0.0 110.229 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.456 ' N ' HG22 ' A' ' 56' ' ' ILE . 5.0 mtp -46.17 -38.33 8.15 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.221 -0.925 . . . . 0.0 109.772 179.681 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -54.69 -62.08 1.89 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.358 -0.838 . . . . 0.0 110.048 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -23.11 58.86 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.969 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.769 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -73.95 -31.75 31.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.295 -0.878 . . . . 0.0 109.834 179.718 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.79 ' CZ2' ' HE1' ' A' ' 81' ' ' MET . 14.0 m95 -76.29 -63.44 1.33 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.138 -0.976 . . . . 0.0 110.265 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -44.83 -45.43 10.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.297 -0.877 . . . . 0.0 110.405 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -69.69 -34.15 73.52 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.286 -0.884 . . . . 0.0 110.386 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.979 HD22 HD11 ' A' ' 106' ' ' LEU . 7.5 mt -57.51 -20.52 31.99 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.221 -0.925 . . . . 0.0 110.42 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.4 m120 . . . . . 0 C--N 1.303 -1.428 0 O-C-N 121.252 -0.905 . . . . 0.0 110.136 -179.712 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 47.7 p-90 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.237 0.541 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.76 -28.52 22.68 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.262 -0.899 . . . . 0.0 110.018 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.1 -35.12 49.65 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.269 -0.894 . . . . 0.0 110.021 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.776 HG22 ' O ' ' A' ' 64' ' ' LEU . 13.3 t -60.65 -55.31 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.338 -0.851 . . . . 0.0 109.758 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -52.48 -52.85 52.26 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.35 -0.844 . . . . 0.0 109.874 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.501 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -61.13 -24.84 66.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.314 -0.866 . . . . 0.0 109.991 179.715 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.765 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -74.64 -34.02 62.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.309 -0.869 . . . . 0.0 109.997 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.624 ' SD ' ' HB2' ' A' ' 127' ' ' ALA . 0.0 OUTLIER -66.87 -30.87 71.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.371 -0.831 . . . . 0.0 109.462 179.513 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.2 m -66.73 -64.05 0.94 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.499 -0.75 . . . . 0.0 109.946 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.965 ' CD2' HG13 ' A' ' 24' ' ' VAL . 29.9 tp -46.87 -46.81 21.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.322 -0.861 . . . . 0.0 110.135 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' MET . . . . . 1.012 ' HG2' HD21 ' A' ' 130' ' ' LEU . 19.6 ttm -56.53 -42.99 79.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.114 -0.991 . . . . 0.0 110.205 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.718 ' HA ' HD12 ' A' ' 85' ' ' ILE . 62.6 tt0 -68.49 -65.91 0.64 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.243 -0.91 . . . . 0.0 110.336 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.582 ' O ' HG22 ' A' ' 87' ' ' THR . 57.9 t80 -37.52 -47.78 0.94 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.454 -0.779 . . . . 0.0 110.791 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.702 HD23 ' HB2' ' A' ' 44' ' ' ALA . 68.4 mt -68.03 -43.93 77.64 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.842 . . . . 0.0 110.222 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.001 HD13 HD11 ' A' ' 134' ' ' LEU . 23.5 mt -47.9 -29.54 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.033 -1.042 . . . . 0.0 109.75 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.63 -72.6 0.61 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.326 -0.859 . . . . 0.0 110.111 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.582 HG22 ' O ' ' A' ' 83' ' ' TYR . 8.0 t -83.8 -27.44 28.8 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.278 -0.889 . . . . 0.0 110.108 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.558 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -44.16 -85.83 0.01 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.466 ' O ' ' HB ' ' A' ' 92' ' ' VAL . 1.3 t -175.78 154.44 1.54 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -1.184 . . . . 0.0 110.382 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -47.68 -44.98 27.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.247 -0.908 . . . . 0.0 110.615 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -59.47 -43.43 93.24 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.42 -0.8 . . . . 0.0 110.199 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.625 HG11 ' CB ' ' A' ' 84' ' ' LEU . 18.9 t -53.12 -25.55 9.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.483 0 O-C-N 121.318 -0.864 . . . . 0.0 109.85 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.0 t -91.2 -35.13 14.7 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 110.059 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -61.61 -53.01 61.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.294 -0.878 . . . . 0.0 110.018 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 5.0 tt0 -60.22 -38.52 83.63 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.332 -0.855 . . . . 0.0 109.254 179.451 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.651 ' SG ' HD11 ' A' ' 85' ' ' ILE . 0.1 OUTLIER -55.77 -30.19 60.88 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.104 -0.998 . . . . 0.0 109.016 179.144 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.53 -23.55 27.66 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.447 -0.783 . . . . 0.0 110.254 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 4.8 pt-20 -80.42 -21.5 42.14 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.189 -0.944 . . . . 0.0 109.635 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.54 41.13 2.9 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.494 -0.754 . . . . 0.0 109.836 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' MET . . . . . 0.431 ' HG3' ' N ' ' A' ' 101' ' ' TYR . 0.4 OUTLIER -61.04 -24.85 66.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.353 -0.842 . . . . 0.0 110.255 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.471 ' O ' ' HB ' ' A' ' 105' ' ' THR . 20.6 m-85 -68.67 -27.87 66.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.0 109.673 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 1.011 ' O ' HG22 ' A' ' 105' ' ' THR . . . -75.64 -43.62 46.85 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.439 -0.788 . . . . 0.0 110.062 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.607 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.9 t -71.36 -29.03 33.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.413 -0.804 . . . . 0.0 110.042 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.48 ' HG2' HG21 ' A' ' 131' ' ' VAL . 0.3 OUTLIER -83.56 -28.59 28.47 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.215 -0.928 . . . . 0.0 110.362 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 105' ' ' THR . . . . . 1.011 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.1 t -60.84 -23.51 65.16 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.193 -0.942 . . . . 0.0 110.108 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.979 HD11 HD22 ' A' ' 64' ' ' LEU . 19.0 mt -65.06 -41.95 94.66 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.233 -0.917 . . . . 0.0 109.936 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.492 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 31.2 ttpt . . . . . 0 N--CA 1.489 1.503 0 O-C-N 121.307 -0.871 . . . . 0.0 110.185 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.548 HG12 ' N ' ' A' ' 122' ' ' ASN . 32.4 t . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.274 0.559 . . . . 0.0 111.422 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.548 ' N ' HG12 ' A' ' 121' ' ' VAL . 14.5 m120 -33.01 -55.62 0.39 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.733 -0.604 . . . . 0.0 111.414 -178.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.601 ' CG2' HG12 ' A' ' 74' ' ' VAL . 9.9 p -66.69 -39.7 84.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 120.852 -1.155 . . . . 0.0 109.904 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.513 ' N ' HG13 ' A' ' 123' ' ' VAL . 8.9 ttp180 -62.03 -70.9 0.17 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.167 -0.958 . . . . 0.0 110.634 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.403 ' N ' ' HG2' ' A' ' 124' ' ' ARG . 21.8 mt-10 -55.2 -28.67 54.68 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.241 -0.912 . . . . 0.0 110.656 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.498 ' CB ' ' O ' ' A' ' 122' ' ' ASN . 6.1 tptp -62.35 -62.4 1.78 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.092 -1.005 . . . . 0.0 109.578 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.624 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -47.7 -40.87 21.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.356 -0.84 . . . . 0.0 110.004 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.419 ' HG3' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -60.26 -40.31 89.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.215 -0.928 . . . . 0.0 110.381 -179.918 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -54.22 26.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.205 -0.934 . . . . 0.0 110.479 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 1.012 HD21 ' HG2' ' A' ' 81' ' ' MET . 11.7 tp -46.95 -28.98 1.81 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.171 -0.956 . . . . 0.0 109.929 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.48 HG21 ' HG2' ' A' ' 104' ' ' GLN . 28.8 t -79.98 -38.77 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.347 -0.846 . . . . 0.0 109.784 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.81 -47.94 81.16 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.327 -0.858 . . . . 0.0 110.249 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 24.9 tp -54.38 -47.79 72.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.287 -0.883 . . . . 0.0 110.399 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 1.001 HD11 HD13 ' A' ' 85' ' ' ILE . 9.3 mt . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.162 -0.961 . . . . 0.0 110.237 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.26 0.552 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.754 ' CA ' HD13 ' A' ' 46' ' ' LEU . . . -53.31 -49.0 67.94 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.275 -0.891 . . . . 0.0 110.117 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.44 ' CG ' ' N ' ' A' ' 22' ' ' ILE . 14.4 pt-20 -44.06 -37.58 3.1 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.992 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.44 ' N ' ' CG ' ' A' ' 21' ' ' GLU . 29.3 mm -72.07 -42.63 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.322 -0.861 . . . . 0.0 110.074 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.597 ' O ' HD11 ' A' ' 39' ' ' LEU . 29.0 mmtt -56.41 -32.75 65.14 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.178 -0.951 . . . . 0.0 110.226 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.566 HG21 ' HA ' ' A' ' 56' ' ' ILE . 90.1 t -76.75 -37.46 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.294 -0.879 . . . . 0.0 110.191 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.3 -37.89 75.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.171 -0.956 . . . . 0.0 110.24 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -82.83 -48.85 10.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.328 -0.857 . . . . 0.0 110.164 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 1.087 ' HB2' HD12 ' A' ' 39' ' ' LEU . . . -44.6 -47.78 10.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.9 . . . . 0.0 110.17 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.48 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 4.8 p . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.346 -0.846 . . . . 0.0 110.183 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 1.087 HD12 ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.271 0.558 . . . . 0.0 110.229 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -90.28 -59.38 2.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.281 -0.887 . . . . 0.0 110.203 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.07 -12.44 61.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.301 -0.874 . . . . 0.0 110.228 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -83.98 -66.01 0.94 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.292 -0.88 . . . . 0.0 110.336 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.598 HG21 HD11 ' A' ' 80' ' ' LEU . 79.8 mt -46.24 -38.1 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.217 -0.927 . . . . 0.0 110.094 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.752 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -68.11 -52.01 39.83 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.184 -0.948 . . . . 0.0 109.387 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.526 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 19.7 t0 -53.61 -20.84 5.68 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.064 -1.022 . . . . 0.0 108.912 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.754 HD13 ' CA ' ' A' ' 20' ' ' ALA . 13.4 mt -81.56 -36.41 29.11 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.578 -0.702 . . . . 0.0 110.06 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.528 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 73.1 p -52.19 -40.92 62.18 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.08 -1.013 . . . . 0.0 109.157 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.558 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 79.6 m-85 -43.22 -43.87 4.96 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 119.556 -0.857 . . . . 0.0 109.394 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 51' ' ' VAL . 1.2 t-20 -73.72 91.31 1.89 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.62 -0.675 . . . . 0.0 110.45 179.454 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -11.56 -56.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.696 178.183 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.548 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.7 t -63.97 -65.85 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 120.972 -1.08 . . . . 0.0 110.197 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -39.33 -41.96 0.98 Allowed 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 121.241 0.543 . . . . 0.0 110.633 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.577 ' CE1' ' HA ' ' A' ' 92' ' ' VAL . 4.2 t80 -62.1 -57.57 11.09 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.458 -0.776 . . . . 0.0 110.546 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 58' ' ' SER . 0.4 OUTLIER -55.17 -24.7 28.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.21 -0.931 . . . . 0.0 110.418 -179.458 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -87.87 -25.0 23.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.247 -0.908 . . . . 0.0 110.272 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.61 HD11 ' HB3' ' A' ' 46' ' ' LEU . 19.7 mt -74.75 -70.28 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.369 -0.832 . . . . 0.0 110.426 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.465 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 4.2 mtp -45.82 -37.94 6.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.22 -0.925 . . . . 0.0 110.097 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 54' ' ' SER . 0.4 OUTLIER -53.22 -59.02 5.09 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.191 -0.943 . . . . 0.0 109.861 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -27.74 67.83 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.181 -0.949 . . . . 0.0 109.585 179.58 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.881 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -68.82 -29.05 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.425 -0.797 . . . . 0.0 109.705 179.539 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.418 ' CD1' ' O ' ' A' ' 57' ' ' MET . 20.9 m95 -79.08 -37.18 39.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.189 -0.944 . . . . 0.0 110.229 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -62.86 -56.76 14.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.255 -0.903 . . . . 0.0 110.314 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.43 -26.26 68.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.212 -0.93 . . . . 0.0 110.252 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.811 HD11 ' CE ' ' A' ' 81' ' ' MET . 8.4 mt -64.51 -15.43 60.85 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.287 -0.883 . . . . 0.0 110.354 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.6 m120 . . . . . 0 C--N 1.302 -1.489 0 O-C-N 121.249 -0.907 . . . . 0.0 110.354 -179.394 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.485 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 26.0 p-90 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.293 0.568 . . . . 0.0 110.067 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.485 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 4.2 tpt180 -43.47 -43.4 5.35 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.27 -0.894 . . . . 0.0 110.097 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 39.3 m170 -56.86 -47.28 80.77 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.246 -0.909 . . . . 0.0 110.063 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.8 HG11 HD22 ' A' ' 106' ' ' LEU . 59.4 t -51.87 -49.57 36.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.287 -0.883 . . . . 0.0 109.925 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.508 ' CE1' ' HG2' ' A' ' 126' ' ' LYS . 10.0 t80 -51.41 -59.84 3.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.191 -0.943 . . . . 0.0 109.925 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.48 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 8.6 mmtt -52.1 -27.0 12.52 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.905 . . . . 0.0 109.779 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.676 ' HB3' ' O ' ' A' ' 74' ' ' VAL . . . -68.31 -54.36 17.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.376 -0.827 . . . . 0.0 110.232 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.762 ' HE1' HG12 ' A' ' 74' ' ' VAL . 2.3 mpp? -47.09 -38.13 10.82 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.382 -0.823 . . . . 0.0 110.34 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.6 m -67.18 -38.77 85.95 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.165 -0.959 . . . . 0.0 110.212 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.881 ' CD2' HD11 ' A' ' 60' ' ' ILE . 16.7 tp -65.85 -64.58 0.83 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.224 -0.922 . . . . 0.0 109.138 179.119 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.811 ' CE ' HD11 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -51.86 -27.15 11.72 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.268 -0.895 . . . . 0.0 110.331 179.536 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.652 ' HB2' HD22 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -75.84 -35.47 59.96 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.006 -1.059 . . . . 0.0 110.035 179.629 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.579 ' CE2' HG21 ' A' ' 87' ' ' THR . 33.8 t80 -75.81 -58.21 3.42 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.403 -0.811 . . . . 0.0 110.58 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.572 ' HB2' HG11 ' A' ' 92' ' ' VAL . 5.3 mt -46.72 -48.49 20.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.169 -0.957 . . . . 0.0 109.83 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.044 HD13 HD21 ' A' ' 134' ' ' LEU . 63.1 mt -48.23 -43.05 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.107 -0.996 . . . . 0.0 110.322 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.3 tttp -75.55 -78.0 0.12 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.251 -0.906 . . . . 0.0 110.717 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.579 HG21 ' CE2' ' A' ' 83' ' ' TYR . 7.8 t -86.01 -25.61 25.87 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.159 -0.963 . . . . 0.0 110.764 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.752 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -43.48 -80.13 0.05 OUTLIER Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.4 t -172.25 161.6 5.38 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.175 -1.191 . . . . 0.0 110.194 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.4 -27.04 68.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.206 -0.934 . . . . 0.0 110.186 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.431 ' HG3' ' CD2' ' A' ' 53' ' ' PHE . 9.9 ptp180 -72.75 -34.67 67.18 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.197 -0.939 . . . . 0.0 109.852 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.577 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 54.0 t -58.4 -51.63 69.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.284 -0.885 . . . . 0.0 109.942 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.3 t -58.46 -41.36 85.02 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.177 -0.952 . . . . 0.0 109.71 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -57.95 -40.07 79.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.226 -0.921 . . . . 0.0 109.795 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.527 ' HA ' ' HG2' ' A' ' 98' ' ' GLU . 6.4 tp-100 -67.53 -39.37 85.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.315 -0.866 . . . . 0.0 109.397 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.62 ' SG ' HD11 ' A' ' 85' ' ' ILE . 2.7 t -56.59 -31.95 64.76 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.221 -0.924 . . . . 0.0 108.831 179.044 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.446 ' HA ' ' SD ' ' A' ' 100' ' ' MET . 0.8 OUTLIER -81.42 -24.92 36.58 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.512 -0.742 . . . . 0.0 109.771 179.333 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.527 ' HG2' ' HA ' ' A' ' 95' ' ' GLN . 0.1 OUTLIER -77.94 -22.84 48.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.245 -0.909 . . . . 0.0 109.743 179.736 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.502 ' N ' ' HG3' ' A' ' 98' ' ' GLU . 8.4 t30 -132.19 38.53 3.48 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.555 -0.716 . . . . 0.0 109.797 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' MET . . . . . 0.446 ' SD ' ' HA ' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -60.53 -34.72 74.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.834 . . . . 0.0 109.908 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.456 ' O ' ' HB ' ' A' ' 105' ' ' THR . 66.3 m-85 -57.08 -27.96 62.18 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.301 -0.874 . . . . 0.0 109.688 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 1.005 ' O ' HG22 ' A' ' 105' ' ' THR . . . -71.93 -42.86 66.15 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.459 -0.775 . . . . 0.0 110.077 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.658 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 6.2 t -68.81 -28.16 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.702 ' HG2' HG21 ' A' ' 131' ' ' VAL . 1.2 mm100 -90.37 -20.66 22.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.915 . . . . 0.0 110.449 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' THR . . . . . 1.005 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.2 t -61.32 -22.44 64.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.198 -0.939 . . . . 0.0 110.24 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.8 HD22 HG11 ' A' ' 74' ' ' VAL . 35.3 mt -61.44 -39.12 89.65 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 110.204 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 124' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.209 -0.932 . . . . 0.0 110.146 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.552 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.391 0.615 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.552 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.4 m120 -37.72 -28.31 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.816 -0.552 . . . . 0.0 110.804 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' A' ' 121' ' ' VAL . 3.8 t -81.72 -58.72 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.188 -0.945 . . . . 0.0 110.382 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.484 ' HB2' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -50.62 -30.96 14.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.222 -0.924 . . . . 0.0 110.799 -179.476 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.508 ' HG3' HG22 ' A' ' 121' ' ' VAL . 3.3 mt-10 -81.45 -53.76 6.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.221 -0.925 . . . . 0.0 111.169 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.508 ' HG2' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -51.64 -47.12 63.85 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.081 -1.012 . . . . 0.0 110.593 -179.465 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.658 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -67.65 -41.55 83.63 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.3 -0.875 . . . . 0.0 111.003 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 124' ' ' ARG . 0.2 OUTLIER -58.53 -43.84 89.37 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.074 -1.016 . . . . 0.0 110.884 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.452 ' OE1' ' N ' ' A' ' 129' ' ' GLN . 0.5 OUTLIER -64.94 -49.44 70.36 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.086 -1.009 . . . . 0.0 110.803 -179.519 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.652 HD22 ' HB2' ' A' ' 82' ' ' GLU . 12.1 tp -51.26 -41.69 60.55 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.062 -1.024 . . . . 0.0 110.258 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.702 HG21 ' HG2' ' A' ' 104' ' ' GLN . 25.3 t -66.3 -32.77 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.252 -0.905 . . . . 0.0 109.878 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.9 -51.71 56.32 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.145 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.43 ' O ' ' C ' ' A' ' 134' ' ' LEU . 0.5 OUTLIER -61.69 -42.07 98.43 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.323 -0.86 . . . . 0.0 110.446 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 1.044 HD21 HD13 ' A' ' 85' ' ' ILE . 1.5 mm? . . . . . 0 N--CA 1.491 1.621 0 O-C-N 121.309 -0.87 . . . . 0.0 110.299 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.242 0.544 . . . . 0.0 110.385 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.481 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -58.91 -47.22 85.78 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.297 -0.877 . . . . 0.0 110.182 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.425 ' HG3' HG12 ' A' ' 22' ' ' ILE . 10.4 pt-20 -45.22 -30.95 1.33 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.275 -0.891 . . . . 0.0 109.991 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.425 HG12 ' HG3' ' A' ' 21' ' ' GLU . 27.9 mm -75.5 -44.74 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.345 -0.847 . . . . 0.0 110.038 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.483 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 2.9 mmtp -55.53 -51.88 65.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.244 -0.91 . . . . 0.0 110.003 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.833 HG21 ' HA ' ' A' ' 56' ' ' ILE . 98.7 t -58.57 -37.63 66.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.224 -0.923 . . . . 0.0 110.064 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -69.05 0.13 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.253 -0.904 . . . . 0.0 109.977 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -64.08 -13.64 48.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.423 -0.798 . . . . 0.0 110.199 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.863 ' HB2' HD12 ' A' ' 39' ' ' LEU . . . -77.0 -30.3 55.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.249 -0.907 . . . . 0.0 110.082 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.492 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 32.7 p . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.304 -0.872 . . . . 0.0 110.031 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.863 HD12 ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.232 0.539 . . . . 0.0 110.247 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.35 -53.75 9.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.268 -0.895 . . . . 0.0 110.235 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.3 t -56.75 -27.46 59.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.198 -0.939 . . . . 0.0 110.207 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.16 -50.19 12.43 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.3 -0.875 . . . . 0.0 110.233 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.732 HG21 HD11 ' A' ' 80' ' ' LEU . 82.1 mt -56.31 -36.48 46.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.201 -0.937 . . . . 0.0 110.012 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.638 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -67.65 -49.85 60.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.303 -0.873 . . . . 0.0 109.654 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.482 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 25.8 t70 -55.31 -18.86 7.12 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.124 -0.985 . . . . 0.0 109.141 179.129 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.507 ' HB3' ' HB1' ' A' ' 52' ' ' ALA . 10.7 mt -85.32 -34.22 21.91 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.529 -0.732 . . . . 0.0 110.119 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.525 HG21 HG21 ' A' ' 92' ' ' VAL . 76.1 p -56.23 -41.08 75.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.153 -0.967 . . . . 0.0 109.521 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.582 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 85.4 m-85 -43.3 -43.69 5.06 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 119.776 -0.77 . . . . 0.0 109.195 179.466 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.479 ' HB2' ' O ' ' A' ' 46' ' ' LEU . 5.6 m-20 -58.87 -160.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.662 0.744 . . . . 0.0 110.051 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 m -122.01 -32.35 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.547 HG12 ' N ' ' A' ' 52' ' ' ALA . 10.6 t -85.64 -70.86 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 CA-C-O 121.947 0.88 . . . . 0.0 109.806 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.567 ' O ' HD12 ' A' ' 56' ' ' ILE . . . -38.31 -40.38 0.52 Allowed 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.787 -177.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.669 ' CE1' HG22 ' A' ' 92' ' ' VAL . 7.4 t80 -55.39 -58.86 6.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.257 -0.902 . . . . 0.0 110.291 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 58' ' ' SER . 67.3 m -55.62 -41.08 72.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.18 -0.95 . . . . 0.0 110.086 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.6 -25.08 67.24 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.359 -0.838 . . . . 0.0 109.971 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.833 ' HA ' HG21 ' A' ' 24' ' ' VAL . 10.8 mt -79.33 -70.4 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.404 -0.81 . . . . 0.0 110.144 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.445 ' HA ' ' HB ' ' A' ' 60' ' ' ILE . 15.3 mtp -47.96 -39.82 20.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.192 -0.943 . . . . 0.0 109.596 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.447 ' HB2' ' O ' ' A' ' 54' ' ' SER . 38.5 t -53.42 -57.29 11.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.325 -0.86 . . . . 0.0 109.762 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.445 ' HB2' HG11 ' A' ' 24' ' ' VAL . 8.8 mmt -62.17 -23.17 66.44 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.232 -0.918 . . . . 0.0 109.596 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.69 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -72.42 -31.74 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.405 -0.81 . . . . 0.0 109.29 179.524 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -74.7 -44.99 47.29 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.352 -0.842 . . . . 0.0 109.722 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.59 -52.93 61.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.254 -0.904 . . . . 0.0 109.705 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 14.5 mmp_? -62.7 -35.79 80.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.229 -0.92 . . . . 0.0 109.713 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 1.031 ' O ' HG22 ' A' ' 74' ' ' VAL . 4.1 mt -54.4 -24.02 18.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.351 -0.843 . . . . 0.0 110.052 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.7 t30 . . . . . 0 C--N 1.299 -1.615 0 O-C-N 121.469 -0.769 . . . . 0.0 109.141 179.915 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.519 ' CZ3' ' HB2' ' A' ' 122' ' ' ASN . 58.4 p-90 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 121.137 0.494 . . . . 0.0 110.468 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.0 mmt180 -71.44 -70.35 0.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.188 -0.945 . . . . 0.0 110.492 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -55.98 -49.46 73.52 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.214 -0.929 . . . . 0.0 110.138 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 1.031 HG22 ' O ' ' A' ' 64' ' ' LEU . 68.8 t -44.0 -53.01 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.434 -0.791 . . . . 0.0 110.488 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.511 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 5.3 t80 -49.68 -56.27 10.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.273 -0.892 . . . . 0.0 110.196 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.492 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -56.59 -28.53 60.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.201 -0.937 . . . . 0.0 110.144 179.945 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.886 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -71.14 -34.92 71.48 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.361 -0.837 . . . . 0.0 109.81 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.838 ' HE1' HG22 ' A' ' 123' ' ' VAL . 0.6 OUTLIER -61.8 -38.9 89.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.472 -0.768 . . . . 0.0 109.715 179.52 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 40.9 m -61.04 -63.91 1.13 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.278 -0.889 . . . . 0.0 110.058 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.749 HD21 HG22 ' A' ' 24' ' ' VAL . 20.1 tp -47.35 -54.1 12.03 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.212 -0.93 . . . . 0.0 110.068 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.873 ' HG2' HD22 ' A' ' 130' ' ' LEU . 3.7 ttp -50.76 -37.25 40.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.193 -0.942 . . . . 0.0 110.365 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.538 ' HA ' HD21 ' A' ' 130' ' ' LEU . 26.2 tt0 -74.17 -68.58 0.51 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.096 -1.003 . . . . 0.0 110.574 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.565 ' CE2' HG21 ' A' ' 87' ' ' THR . 55.0 t80 -37.58 -45.91 0.8 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.494 -0.754 . . . . 0.0 111.367 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.558 ' CB ' HG11 ' A' ' 92' ' ' VAL . 75.6 mt -66.68 -42.31 86.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.14 -0.975 . . . . 0.0 110.695 -179.243 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.909 HD13 HD11 ' A' ' 134' ' ' LEU . 32.3 mt -52.73 -19.91 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 120.933 -1.104 . . . . 0.0 110.158 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.82 -87.96 0.44 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.297 -0.877 . . . . 0.0 110.293 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.565 HG21 ' CE2' ' A' ' 83' ' ' TYR . 14.9 t -69.41 -6.21 28.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.224 -0.922 . . . . 0.0 110.222 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.638 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -72.19 -78.74 0.48 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.3 t -174.81 157.01 2.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.11 -1.229 . . . . 0.0 110.234 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.92 -21.84 65.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.302 -0.874 . . . . 0.0 110.191 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.28 -39.5 59.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.22 -0.925 . . . . 0.0 110.08 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.669 HG22 ' CE1' ' A' ' 53' ' ' PHE . 78.4 t -58.69 -31.48 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.289 -0.882 . . . . 0.0 110.074 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 29.6 p -79.06 -38.69 35.79 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.159 -0.963 . . . . 0.0 110.018 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -59.67 -59.37 5.55 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.283 -0.885 . . . . 0.0 109.832 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.42 -35.85 63.37 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.481 -0.762 . . . . 0.0 109.8 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.562 ' HB3' HD13 ' A' ' 134' ' ' LEU . 11.6 m -60.91 -36.38 79.12 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.19 -0.944 . . . . 0.0 109.713 179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -73.83 -26.63 60.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.403 -0.811 . . . . 0.0 109.589 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -81.85 -22.84 36.76 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.373 -0.829 . . . . 0.0 110.057 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -111.52 34.75 3.95 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.286 -0.884 . . . . 0.0 110.34 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.6 ptp -60.97 -31.06 70.65 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.215 -0.928 . . . . 0.0 110.17 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -61.42 -26.27 67.75 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.888 . . . . 0.0 110.2 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 1.022 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.65 -40.75 48.15 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.244 -0.91 . . . . 0.0 110.15 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.573 HG22 ' HE1' ' A' ' 81' ' ' MET . 5.3 t -72.12 -27.46 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.376 -0.828 . . . . 0.0 110.151 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.73 ' NE2' HG11 ' A' ' 131' ' ' VAL . 15.5 mm-40 -82.18 -26.89 32.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.174 -0.954 . . . . 0.0 110.315 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' THR . . . . . 1.022 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.1 t -64.85 -12.64 50.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.128 -0.983 . . . . 0.0 110.04 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 1.002 HD11 HD22 ' A' ' 64' ' ' LEU . 65.4 mt -77.23 -33.17 56.18 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.274 -0.891 . . . . 0.0 110.181 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.536 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 1.2 ttmt . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.378 -0.827 . . . . 0.0 110.464 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.542 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 2.8 p . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 121.277 0.561 . . . . 0.0 110.146 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.542 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.6 m120 -36.13 -31.2 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.833 -0.542 . . . . 0.0 110.775 -179.669 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.838 HG22 ' HE1' ' A' ' 78' ' ' MET . 1.0 OUTLIER -82.19 -46.07 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.263 -0.898 . . . . 0.0 109.917 179.783 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.536 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -57.35 -30.88 65.2 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.203 -0.936 . . . . 0.0 110.61 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.457 ' OE1' HG13 ' A' ' 121' ' ' VAL . 44.8 mt-10 -82.71 -54.75 4.89 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.196 -0.94 . . . . 0.0 111.055 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.511 ' HG3' ' CE1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -52.62 -49.64 64.71 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.096 -1.002 . . . . 0.0 110.235 -179.631 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.523 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -61.14 -41.62 97.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.314 -0.866 . . . . 0.0 110.431 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 124' ' ' ARG . 2.4 ttmt -56.9 -49.66 74.91 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.161 -0.962 . . . . 0.0 110.369 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -55.2 -49.59 71.54 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 110.379 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.873 HD22 ' HG2' ' A' ' 81' ' ' MET . 0.3 OUTLIER -53.29 -40.82 65.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.161 -0.962 . . . . 0.0 110.161 -179.916 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.73 HG11 ' NE2' ' A' ' 104' ' ' GLN . 26.4 t -72.75 -25.91 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.356 -0.84 . . . . 0.0 110.191 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.23 -56.17 7.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.218 -0.926 . . . . 0.0 110.389 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 15.7 tp -69.9 -37.8 76.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.289 -0.882 . . . . 0.0 110.377 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.909 HD11 HD13 ' A' ' 85' ' ' ILE . 30.9 mt . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.154 -0.966 . . . . 0.0 110.206 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.21 0.528 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.953 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -65.01 -52.97 53.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.233 -0.917 . . . . 0.0 110.15 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.409 ' CG ' ' N ' ' A' ' 22' ' ' ILE . 12.5 pt-20 -50.1 -34.1 20.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.236 -0.915 . . . . 0.0 110.053 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.409 ' N ' ' CG ' ' A' ' 21' ' ' GLU . 13.4 mt -66.07 -39.41 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.255 -0.903 . . . . 0.0 109.934 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.457 ' CB ' HG12 ' A' ' 43' ' ' ILE . 1.6 mmtm -67.11 -39.55 86.69 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.296 -0.877 . . . . 0.0 110.017 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.768 HG13 HD23 ' A' ' 80' ' ' LEU . 56.1 t -57.83 -38.68 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.353 -0.842 . . . . 0.0 110.091 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.508 ' HD3' ' CZ ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -63.35 -50.68 69.01 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.281 -0.887 . . . . 0.0 110.157 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 49.1 tt0 -68.95 -17.05 63.89 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.432 -0.793 . . . . 0.0 109.959 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.737 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -79.78 -33.16 40.79 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.343 -0.848 . . . . 0.0 110.147 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.497 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 82.3 p . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.211 -0.93 . . . . 0.0 110.107 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.737 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.283 0.563 . . . . 0.0 110.22 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 5.4 mtt -67.48 -62.2 1.53 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.171 -0.955 . . . . 0.0 110.234 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.44 -24.2 7.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.263 -0.898 . . . . 0.0 110.267 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.83 -54.02 8.06 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.156 -0.965 . . . . 0.0 110.176 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.589 HD11 ' HB2' ' A' ' 27' ' ' ALA . 79.3 mt -52.96 -32.85 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.149 -0.969 . . . . 0.0 109.951 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.527 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.23 -52.91 19.54 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.182 -0.949 . . . . 0.0 109.62 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.598 ' HA ' ' CD1' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -51.55 -21.46 2.52 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.021 -1.049 . . . . 0.0 109.455 179.268 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.953 HD22 ' HB2' ' A' ' 20' ' ' ALA . 4.6 mt -76.92 -40.97 45.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.429 -0.794 . . . . 0.0 110.133 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.689 HG21 ' CG2' ' A' ' 92' ' ' VAL . 42.9 p -53.97 -43.07 69.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.257 -0.902 . . . . 0.0 109.712 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.598 ' CD1' ' HA ' ' A' ' 45' ' ' ASP . 81.6 m-85 -40.48 -38.96 0.92 Allowed 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 119.945 -0.702 . . . . 0.0 109.529 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.466 ' O ' ' O ' ' A' ' 48' ' ' TYR . 13.7 m120 -58.08 -152.71 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.69 0.757 . . . . 0.0 110.168 179.057 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.7 t -128.11 -15.89 2.68 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.275 -177.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.646 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 0.3 OUTLIER -110.14 -48.1 6.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 CA-C-O 122.42 1.105 . . . . 0.0 108.569 179.151 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.695 ' HB1' ' HB3' ' A' ' 46' ' ' LEU . . . -48.82 -47.27 42.54 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.37 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.548 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 2.1 t80 -56.88 -54.7 43.48 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.374 -0.829 . . . . 0.0 109.819 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.88 -21.62 61.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.276 -0.89 . . . . 0.0 110.325 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' A' ' 51' ' ' VAL . 2.8 mm-40 -90.72 -19.6 23.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.309 -0.87 . . . . 0.0 110.048 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.629 HG21 HD13 ' A' ' 84' ' ' LEU . 7.3 mt -80.77 -70.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.383 -0.823 . . . . 0.0 110.0 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.574 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 95.8 mmm -45.17 -35.57 3.31 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -56.9 -59.56 4.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.345 -0.847 . . . . 0.0 109.806 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.451 ' HB3' HG11 ' A' ' 24' ' ' VAL . 0.0 OUTLIER -59.08 -25.64 63.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.333 -0.854 . . . . 0.0 109.966 179.653 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.692 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -74.15 -29.97 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.364 -0.835 . . . . 0.0 109.936 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.574 ' CD1' ' O ' ' A' ' 57' ' ' MET . 18.2 m95 -76.07 -44.76 37.43 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.158 -0.964 . . . . 0.0 110.387 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -49.06 79.11 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.222 -0.924 . . . . 0.0 110.434 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.508 ' CZ ' ' HD3' ' A' ' 25' ' ' ARG . 12.5 mmt85 -70.6 -32.02 69.23 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.22 -0.925 . . . . 0.0 110.32 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.995 HD22 HD11 ' A' ' 106' ' ' LEU . 3.9 mt -57.0 -18.67 14.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.319 -0.863 . . . . 0.0 110.503 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.0 t30 . . . . . 0 C--N 1.301 -1.504 0 O-C-N 121.238 -0.914 . . . . 0.0 109.935 -179.953 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 47.4 p-90 . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.203 0.525 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 73' ' ' HIS . 1.3 ptp180 -55.56 -27.11 47.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.255 -0.903 . . . . 0.0 110.224 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.424 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -72.71 -36.14 67.74 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 109.986 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.705 HG12 ' HE2' ' A' ' 78' ' ' MET . 55.6 t -62.62 -59.16 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.318 -0.864 . . . . 0.0 110.024 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.639 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 15.8 t80 -46.78 -43.57 18.36 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.253 -0.904 . . . . 0.0 110.055 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.497 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 7.5 mmtp -65.18 -37.11 86.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.256 -0.902 . . . . 0.0 110.166 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.742 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -65.9 -27.24 68.05 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.224 -0.922 . . . . 0.0 110.015 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.785 ' SD ' ' HB2' ' A' ' 127' ' ' ALA . 0.0 OUTLIER -71.4 -39.39 71.17 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.363 -0.836 . . . . 0.0 110.396 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 39.1 m -63.68 -35.81 81.77 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.168 -0.958 . . . . 0.0 110.129 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.768 HD23 HG13 ' A' ' 24' ' ' VAL . 33.3 tp -75.98 -37.38 58.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.145 -0.972 . . . . 0.0 109.614 179.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.558 ' HE2' HD11 ' A' ' 64' ' ' LEU . 3.4 ttp -72.7 -20.85 61.15 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.269 -0.894 . . . . 0.0 109.97 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.58 ' CA ' HD11 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -89.79 -36.29 15.22 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.266 -0.896 . . . . 0.0 110.244 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.633 ' CE1' ' CG2' ' A' ' 87' ' ' THR . 22.6 t80 -73.25 -42.25 62.76 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.363 -0.835 . . . . 0.0 110.698 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.65 ' CB ' HG11 ' A' ' 92' ' ' VAL . 57.4 mt -67.4 -30.12 69.79 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.255 -0.903 . . . . 0.0 110.365 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.015 HG21 HD11 ' A' ' 134' ' ' LEU . 17.7 mt -68.66 -13.11 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.084 -1.01 . . . . 0.0 110.039 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.67 -66.96 0.91 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 109.971 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.633 ' CG2' ' CE1' ' A' ' 83' ' ' TYR . 11.5 t -97.13 8.11 45.21 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.341 -0.849 . . . . 0.0 109.94 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.619 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -95.93 30.81 7.97 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.516 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.8 OUTLIER 72.29 156.98 0.17 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.305 -1.115 . . . . 0.0 110.288 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 6.8 mt-10 -68.43 -9.96 52.01 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.275 -0.89 . . . . 0.0 110.507 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -69.59 -45.53 68.39 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.305 -0.872 . . . . 0.0 109.638 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.689 ' CG2' HG21 ' A' ' 47' ' ' THR . 99.3 t -52.76 -40.53 35.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 121.503 -0.748 . . . . 0.0 109.768 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.8 m -68.48 -39.32 81.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.296 -0.878 . . . . 0.0 109.506 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 90' ' ' GLU . 8.7 mt-30 -55.85 -35.5 66.5 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.331 -0.856 . . . . 0.0 109.397 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.535 ' HA ' ' HG2' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -70.08 -40.2 75.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.451 -0.78 . . . . 0.0 109.014 178.956 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.492 ' SG ' HD22 ' A' ' 134' ' ' LEU . 21.7 t -55.3 -31.95 62.05 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.239 -0.913 . . . . 0.0 108.959 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.9 mttt -82.14 -25.87 34.0 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.567 -0.708 . . . . 0.0 109.924 179.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.535 ' HG2' ' HA ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -75.36 -21.98 57.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 109.856 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.504 ' N ' ' HG3' ' A' ' 98' ' ' GLU . 22.6 t-20 -140.77 44.79 1.82 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.407 -0.808 . . . . 0.0 109.977 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 28.5 ttp -59.92 -36.07 76.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.908 . . . . 0.0 110.025 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.448 ' O ' ' HB ' ' A' ' 105' ' ' THR . 8.7 m-30 -57.62 -27.04 62.42 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.389 -0.819 . . . . 0.0 109.972 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.984 ' O ' HG22 ' A' ' 105' ' ' THR . . . -69.06 -41.5 77.51 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.385 -0.822 . . . . 0.0 110.085 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.463 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 3.4 t -73.88 -29.7 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.373 -0.83 . . . . 0.0 109.84 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.627 ' HG2' HG21 ' A' ' 131' ' ' VAL . 7.5 mt-30 -83.45 -20.18 34.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.417 -0.802 . . . . 0.0 110.219 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.984 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.5 t -72.34 -20.0 61.55 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.255 -0.903 . . . . 0.0 110.19 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.995 HD11 HD22 ' A' ' 64' ' ' LEU . 12.2 mt -64.3 -39.75 94.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.267 -0.896 . . . . 0.0 109.937 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 104' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.271 -0.893 . . . . 0.0 110.143 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.564 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.6 p . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 121.315 0.579 . . . . 0.0 110.223 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.564 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.7 OUTLIER -39.37 -44.01 1.27 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.59 -0.694 . . . . 0.0 110.61 -179.843 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.65 HG13 ' HE1' ' A' ' 78' ' ' MET . 1.4 t -78.86 -48.67 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.339 -0.85 . . . . 0.0 110.202 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.445 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -44.04 -51.05 8.14 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.272 -0.893 . . . . 0.0 111.201 -179.365 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.486 ' OE2' ' HA ' ' A' ' 122' ' ' ASN . 14.2 pt-20 -72.72 -34.26 66.99 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.273 -0.892 . . . . 0.0 111.186 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.744 ' HB3' ' HE3' ' A' ' 78' ' ' MET . 0.8 OUTLIER -59.04 -54.6 45.29 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.972 -1.08 . . . . 0.0 110.289 -179.776 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.785 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -59.83 -42.94 94.66 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.338 -0.851 . . . . 0.0 110.488 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -60.5 -34.62 74.34 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.236 -0.915 . . . . 0.0 110.477 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.537 ' O ' ' HB3' ' A' ' 132' ' ' ALA . 1.9 mt-30 -65.48 -42.87 91.72 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.298 -0.876 . . . . 0.0 110.48 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.846 HD21 HD12 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -58.14 -56.09 26.53 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.034 -1.042 . . . . 0.0 109.948 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.627 HG21 ' HG2' ' A' ' 104' ' ' GLN . 55.4 t -53.78 -23.6 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.449 -0.782 . . . . 0.0 109.837 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 129' ' ' GLN . . . -76.22 -56.12 4.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.447 -0.783 . . . . 0.0 110.503 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.98 -34.16 54.67 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.342 -0.849 . . . . 0.0 110.582 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 1.015 HD11 HG21 ' A' ' 85' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.188 -0.945 . . . . 0.0 110.451 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.433 ' OE1' HD21 ' A' ' 46' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 121.173 0.511 . . . . 0.0 110.675 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.899 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -71.16 -55.23 8.58 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.193 -0.942 . . . . 0.0 110.625 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HG3' HG12 ' A' ' 22' ' ' ILE . 19.7 pt-20 -41.01 -27.45 0.06 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.291 -0.881 . . . . 0.0 110.461 -179.69 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.465 HG12 ' HG3' ' A' ' 21' ' ' GLU . 23.5 mm -82.74 -57.81 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.271 -0.893 . . . . 0.0 110.308 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.866 ' O ' HD11 ' A' ' 43' ' ' ILE . 26.2 mttt -53.9 -19.05 3.96 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.241 -0.912 . . . . 0.0 110.409 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.934 HG21 ' HA ' ' A' ' 56' ' ' ILE . 6.7 t -89.32 -37.39 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.204 -0.935 . . . . 0.0 110.12 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.501 ' NH2' ' NH1' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -64.66 -36.95 85.93 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.295 -0.878 . . . . 0.0 110.228 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -85.19 -40.56 16.55 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.273 -0.892 . . . . 0.0 110.259 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.613 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . . . -49.48 -38.51 30.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 0.0 110.174 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.578 HG22 ' HA ' ' A' ' 77' ' ' ALA . 63.6 p . . . . . 0 N--CA 1.492 1.67 0 O-C-N 121.307 -0.87 . . . . 0.0 110.25 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.613 ' CD1' ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.247 0.546 . . . . 0.0 110.319 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.574 ' HG3' ' CG ' ' A' ' 83' ' ' TYR . 36.2 tpp -82.17 -60.14 2.32 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.514 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 7.8 t -56.89 -21.51 30.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.303 -0.873 . . . . 0.0 110.267 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -76.51 -55.78 5.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -0.906 . . . . 0.0 110.221 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.95 HG21 HD11 ' A' ' 80' ' ' LEU . 36.2 mt -49.03 -36.64 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.18 -0.95 . . . . 0.0 110.157 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.521 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -67.63 -55.0 15.04 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.204 -0.935 . . . . 0.0 109.489 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.42 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 22.8 m-20 -50.08 -23.45 2.11 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.097 -1.002 . . . . 0.0 109.14 179.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.923 ' HB3' HD11 ' A' ' 56' ' ' ILE . 7.4 mt -79.1 -40.35 31.36 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.581 -0.699 . . . . 0.0 109.91 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.707 HG21 ' HB3' ' A' ' 84' ' ' LEU . 80.7 p -47.54 -39.71 17.07 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.177 -0.952 . . . . 0.0 109.174 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.575 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 57.9 m-85 -46.06 -50.3 15.36 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 119.384 -0.926 . . . . 0.0 109.289 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.529 ' O ' ' C ' ' A' ' 50' ' ' VAL . 16.5 m-20 -68.14 91.21 0.35 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.57 0.7 . . . . 0.0 110.765 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.529 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -11.0 -57.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.712 178.138 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.527 ' N ' ' O ' ' A' ' 49' ' ' ASN . 2.9 t -64.92 -66.25 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 120.928 -1.108 . . . . 0.0 110.301 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.612 ' O ' HD12 ' A' ' 56' ' ' ILE . . . -37.57 -40.45 0.39 Allowed 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 121.146 0.498 . . . . 0.0 110.762 -177.745 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.599 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 15.1 t80 -59.07 -54.01 51.9 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.334 -0.854 . . . . 0.0 109.998 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.5 t -55.97 -33.22 64.58 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.19 -0.944 . . . . 0.0 109.862 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -75.42 -27.1 58.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.327 -0.858 . . . . 0.0 109.898 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.934 ' HA ' HG21 ' A' ' 24' ' ' VAL . 8.7 mt -79.68 -70.13 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.394 -0.816 . . . . 0.0 110.026 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.599 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 75.3 mmm -46.59 -36.35 6.8 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.274 -0.891 . . . . 0.0 109.563 179.557 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.4 m -55.16 -62.49 1.63 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.366 -0.834 . . . . 0.0 109.939 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.428 ' H ' ' HE3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -59.35 -21.4 59.76 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.188 -0.945 . . . . 0.0 109.798 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.549 ' CG1' HD23 ' A' ' 80' ' ' LEU . 1.0 OUTLIER -76.08 -30.29 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.41 -0.806 . . . . 0.0 109.748 179.871 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.44 ' CD1' ' O ' ' A' ' 57' ' ' MET . 14.0 m95 -76.13 -46.73 27.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.307 -0.87 . . . . 0.0 110.346 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.3 mptt -55.84 -47.67 76.83 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.25 -0.906 . . . . 0.0 110.392 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.501 ' NH1' ' NH2' ' A' ' 25' ' ' ARG . 6.0 mmp_? -75.88 -10.9 59.81 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.326 -0.859 . . . . 0.0 110.338 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.817 ' O ' HD21 ' A' ' 106' ' ' LEU . 6.6 mt -83.55 -17.68 40.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.194 -0.941 . . . . 0.0 110.351 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.5 m-20 . . . . . 0 C--N 1.302 -1.464 0 O-C-N 121.329 -0.857 . . . . 0.0 110.073 -179.567 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.541 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 28.7 p-90 . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.21 0.529 . . . . 0.0 110.332 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.541 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 15.2 mtm-85 -48.85 -40.8 30.91 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.208 -0.933 . . . . 0.0 110.235 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 17.0 m170 -68.04 -47.81 67.37 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.234 -0.917 . . . . 0.0 110.094 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.631 HG11 ' CG1' ' A' ' 123' ' ' VAL . 7.0 t -46.37 -52.42 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.349 -0.844 . . . . 0.0 110.172 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.48 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 19.8 t80 -54.87 -49.05 72.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.342 -0.849 . . . . 0.0 110.33 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.539 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 10.9 mttm -61.92 -22.81 65.9 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.24 -0.913 . . . . 0.0 110.091 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.754 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -80.05 -23.92 41.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.239 -0.913 . . . . 0.0 109.936 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.556 ' HE2' HG12 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -73.81 -38.45 64.57 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.332 -0.855 . . . . 0.0 110.004 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 76' ' ' LYS . 8.9 t -72.1 -34.32 68.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.207 -0.933 . . . . 0.0 110.046 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.95 HD11 HG21 ' A' ' 43' ' ' ILE . 10.1 tp -68.41 -62.0 1.59 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.232 -0.917 . . . . 0.0 108.994 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.819 ' HE1' HG22 ' A' ' 103' ' ' VAL . 2.9 ttm -53.69 -32.32 51.29 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.406 -0.808 . . . . 0.0 109.9 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.7 ' HA ' HD12 ' A' ' 85' ' ' ILE . 2.8 tt0 -72.74 -32.82 65.96 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.247 -0.908 . . . . 0.0 109.634 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.574 ' CG ' ' HG3' ' A' ' 40' ' ' MET . 20.9 t80 -70.75 -38.88 73.53 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.543 -0.723 . . . . 0.0 110.487 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.788 ' HB2' HG11 ' A' ' 92' ' ' VAL . 1.7 mt -70.55 -32.98 70.62 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.107 -0.995 . . . . 0.0 109.578 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.927 HD13 HD21 ' A' ' 134' ' ' LEU . 71.5 mt -61.76 -26.34 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.181 -0.949 . . . . 0.0 110.082 179.654 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.02 -70.64 0.62 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.385 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.521 HG23 ' HB1' ' A' ' 44' ' ' ALA . 13.0 t -94.1 -23.05 18.12 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.236 -0.915 . . . . 0.0 110.4 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.575 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -44.36 -84.54 0.01 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' A' ' 88' ' ' GLY . 14.4 p -178.09 156.37 1.02 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.234 -1.156 . . . . 0.0 110.31 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.78 -21.56 11.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.282 -0.886 . . . . 0.0 110.2 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -70.74 -44.84 65.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.928 . . . . 0.0 109.86 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.788 HG11 ' HB2' ' A' ' 84' ' ' LEU . 55.2 t -53.27 -38.45 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.361 -0.837 . . . . 0.0 109.958 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 96' ' ' CYS . 70.5 m -70.79 -41.06 72.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.316 -0.865 . . . . 0.0 109.98 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.417 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 31.3 mm-40 -57.07 -54.88 41.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.304 -0.872 . . . . 0.0 109.992 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.9 tp60 -55.86 -36.8 67.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.424 -0.797 . . . . 0.0 109.877 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 93' ' ' SER . 4.8 m -60.15 -36.37 77.38 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.315 -0.865 . . . . 0.0 109.736 179.689 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -74.92 -31.8 61.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.683 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 82.2 mt-10 -81.23 -14.78 57.13 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.473 -0.767 . . . . 0.0 110.027 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -123.18 32.87 5.54 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.281 -0.887 . . . . 0.0 110.174 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.6 ttm -58.2 -24.7 60.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.325 -0.86 . . . . 0.0 110.133 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.462 ' O ' ' HB ' ' A' ' 105' ' ' THR . 14.5 m-85 -69.07 -31.83 70.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.919 . . . . 0.0 110.104 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.933 ' O ' HG22 ' A' ' 105' ' ' THR . . . -75.08 -40.03 60.36 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.48 -0.763 . . . . 0.0 110.26 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.819 HG22 ' HE1' ' A' ' 81' ' ' MET . 3.6 t -71.63 -32.37 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.418 -0.801 . . . . 0.0 110.14 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -86.0 -23.36 26.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.281 -0.887 . . . . 0.0 110.508 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.933 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.3 t -51.37 -25.69 6.49 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.082 -1.011 . . . . 0.0 110.002 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.817 HD21 ' O ' ' A' ' 64' ' ' LEU . 50.5 mt -62.39 -43.55 98.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.309 -0.869 . . . . 0.0 110.077 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.51 ' HA ' ' HG2' ' A' ' 124' ' ' ARG . 49.0 mttt . . . . . 0 N--CA 1.492 1.634 0 O-C-N 121.191 -0.943 . . . . 0.0 109.965 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.375 0.607 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.0 OUTLIER -36.12 -30.33 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.143 0.497 . . . . 0.0 110.582 -179.837 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.631 ' CG1' HG11 ' A' ' 74' ' ' VAL . 4.6 t -78.16 -58.45 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 0.0 109.826 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.51 ' HG2' ' HA ' ' A' ' 107' ' ' LYS . 10.4 mtp-105 -42.1 -47.29 4.52 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.243 -0.91 . . . . 0.0 111.038 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -72.28 -48.56 41.49 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.381 -0.825 . . . . 0.0 111.662 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.541 ' HA ' ' CE ' ' A' ' 126' ' ' LYS . 0.0 OUTLIER -52.04 -53.6 40.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.837 -1.164 . . . . 0.0 110.15 -179.278 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.462 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -52.2 -43.25 64.1 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.341 -0.849 . . . . 0.0 110.146 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.3 tmmm? -55.21 -36.59 66.12 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.207 -0.933 . . . . 0.0 110.371 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -57.45 3.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.161 -0.962 . . . . 0.0 110.294 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 1.039 ' O ' HD23 ' A' ' 134' ' ' LEU . 12.2 tp -46.88 -25.5 0.78 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.208 -0.933 . . . . 0.0 110.041 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 30.0 t -86.64 -36.47 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.219 -0.925 . . . . 0.0 110.155 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.73 -60.46 3.07 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.218 -0.927 . . . . 0.0 110.22 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.98 -28.41 9.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.056 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 1.039 HD23 ' O ' ' A' ' 130' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.28 -0.888 . . . . 0.0 110.261 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.36 0.6 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.893 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -58.53 -46.42 86.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.378 -0.826 . . . . 0.0 110.286 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.474 ' OE2' ' CG1' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -43.71 -28.28 0.4 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.14 -0.975 . . . . 0.0 110.081 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.474 ' CG1' ' OE2' ' A' ' 21' ' ' GLU . 9.9 mt -86.76 -54.08 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.291 -0.881 . . . . 0.0 110.133 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.544 ' O ' HD11 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -44.6 -37.87 3.88 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 110.153 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.771 HG21 ' HA ' ' A' ' 56' ' ' ILE . 51.2 t -75.06 -48.57 31.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.232 -0.917 . . . . 0.0 110.145 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -46.66 -41.19 14.42 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.136 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.407 ' O ' ' C ' ' A' ' 27' ' ' ALA . 0.0 OUTLIER -74.05 -47.46 36.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.333 -0.855 . . . . 0.0 110.107 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.697 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -44.44 -47.17 9.88 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.235 -0.916 . . . . 0.0 110.078 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.511 ' HA ' ' HB2' ' A' ' 76' ' ' LYS . 39.5 p . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.32 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.697 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.274 0.559 . . . . 0.0 110.25 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -50.67 22.71 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 110.218 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.434 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 89.0 p -58.47 -29.19 65.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -73.11 -47.65 42.47 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.266 -0.896 . . . . 0.0 110.241 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.906 HG21 HD11 ' A' ' 80' ' ' LEU . 23.1 mt -57.68 -38.65 65.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.233 -0.917 . . . . 0.0 110.226 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.649 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -68.61 -47.18 67.34 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.058 -1.027 . . . . 0.0 109.43 179.503 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.509 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 3.6 t70 -55.41 -18.48 6.94 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.117 -0.99 . . . . 0.0 109.12 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.893 HD13 ' CB ' ' A' ' 20' ' ' ALA . 24.7 mt -85.22 -33.52 22.22 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.531 -0.73 . . . . 0.0 110.191 179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.592 HG21 ' HB3' ' A' ' 84' ' ' LEU . 38.9 p -56.08 -43.74 78.31 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.0 -1.062 . . . . 0.0 109.233 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.544 ' CE2' ' O ' ' A' ' 87' ' ' THR . 95.0 m-85 -41.26 -37.51 0.97 Allowed 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.59 179.537 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.542 ' O ' ' C ' ' A' ' 50' ' ' VAL . 0.8 OUTLIER -80.66 91.21 5.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.591 -0.693 . . . . 0.0 110.365 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.542 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.09 -58.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.26 178.095 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.541 ' N ' ' O ' ' A' ' 49' ' ' ASN . 2.9 t -65.11 -66.03 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.032 -1.042 . . . . 0.0 110.143 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.742 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -38.19 -44.5 0.86 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.295 0.569 . . . . 0.0 110.522 -177.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.543 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 0.6 OUTLIER -56.73 -55.85 28.88 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.425 -0.797 . . . . 0.0 109.925 179.715 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -54.67 -31.81 58.29 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.194 -0.941 . . . . 0.0 110.232 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -77.79 -26.94 50.04 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.307 -0.871 . . . . 0.0 110.193 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.771 ' HA ' HG21 ' A' ' 24' ' ' VAL . 6.3 mt -78.36 -70.3 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.326 -0.859 . . . . 0.0 110.216 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.466 ' HB3' ' HE2' ' A' ' 57' ' ' MET . 3.5 mtp -46.64 -35.48 6.0 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.177 -0.952 . . . . 0.0 109.762 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 t -55.85 -60.97 2.7 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.258 -0.901 . . . . 0.0 109.659 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.458 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.6 OUTLIER -60.45 -20.14 58.86 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.266 -0.897 . . . . 0.0 109.679 179.47 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.627 HD11 ' HG ' ' A' ' 80' ' ' LEU . 1.2 mt -75.67 -31.18 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.413 -0.804 . . . . 0.0 109.645 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -74.74 -50.27 18.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -0.906 . . . . 0.0 110.202 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -56.14 18.4 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.249 -0.907 . . . . 0.0 110.327 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -68.61 -14.18 62.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.246 -0.909 . . . . 0.0 110.427 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.8 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 4.1 mt -77.69 -25.25 49.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.22 -0.925 . . . . 0.0 110.569 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.4 m120 . . . . . 0 C--N 1.301 -1.509 0 O-C-N 121.343 -0.848 . . . . 0.0 110.185 -179.638 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.123 0.487 . . . . 0.0 110.25 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -47.5 -35.82 9.37 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.161 -0.962 . . . . 0.0 109.592 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -61.73 -47.86 83.33 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.343 -0.848 . . . . 0.0 109.742 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.636 HG12 ' HE1' ' A' ' 78' ' ' MET . 58.9 t -50.67 -46.19 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.331 -0.855 . . . . 0.0 109.715 179.553 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.808 ' HB2' HG23 ' A' ' 123' ' ' VAL . 8.4 t80 -57.18 -52.18 66.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.321 -0.862 . . . . 0.0 109.804 179.751 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.511 ' HB2' ' HA ' ' A' ' 28' ' ' THR . 25.9 mmmt -62.54 -19.37 63.59 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.298 -0.877 . . . . 0.0 109.768 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.8 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -79.48 -30.97 42.28 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.399 -0.813 . . . . 0.0 109.927 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' MET . . . . . 1.028 ' HE1' HG22 ' A' ' 123' ' ' VAL . 1.2 mpp? -68.36 -46.47 70.01 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 109.859 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.8 t -67.57 -31.86 72.22 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.249 -0.907 . . . . 0.0 109.808 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.906 HD11 HG21 ' A' ' 43' ' ' ILE . 11.2 tp -66.3 -65.4 0.68 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.347 -0.846 . . . . 0.0 109.033 178.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.928 ' HG2' HD21 ' A' ' 130' ' ' LEU . 9.3 ttt -49.38 -32.75 12.1 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.406 -0.809 . . . . 0.0 110.122 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.717 ' HA ' HD12 ' A' ' 85' ' ' ILE . 1.3 tm-20 -70.36 -38.07 74.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.102 -0.999 . . . . 0.0 110.025 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.834 ' CE1' HG21 ' A' ' 87' ' ' THR . 19.7 t80 -68.21 -34.31 76.01 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.255 -0.903 . . . . 0.0 110.677 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.874 ' HB2' HG11 ' A' ' 92' ' ' VAL . 2.8 mt -80.76 -21.79 40.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.019 -1.051 . . . . 0.0 109.924 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.015 HD13 HD11 ' A' ' 134' ' ' LEU . 19.9 mt -65.93 -24.64 34.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.154 -0.966 . . . . 0.0 109.534 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -103.31 -61.38 1.42 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.361 -0.837 . . . . 0.0 109.901 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.834 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.0 t -98.34 11.39 38.18 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.299 -0.876 . . . . 0.0 109.974 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.652 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -102.2 29.69 11.96 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 72.6 153.32 0.13 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.391 -1.064 . . . . 0.0 110.43 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.78 -8.71 22.88 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.367 -0.833 . . . . 0.0 110.378 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.416 ' O ' ' HB2' ' A' ' 94' ' ' GLN . 10.4 mmp_? -70.96 -45.07 64.75 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.284 -0.885 . . . . 0.0 109.842 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.874 HG11 ' HB2' ' A' ' 84' ' ' LEU . 91.0 t -52.45 -47.09 47.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 O-C-N 121.409 -0.807 . . . . 0.0 109.898 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.8 t -64.55 -36.78 85.34 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.215 -0.928 . . . . 0.0 109.92 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.477 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 56.3 mm-40 -58.08 -46.65 85.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.248 -0.908 . . . . 0.0 109.844 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.457 ' HB3' ' SD ' ' A' ' 57' ' ' MET . 4.8 tp60 -60.25 -39.82 88.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.835 . . . . 0.0 109.59 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.823 ' SG ' HD22 ' A' ' 134' ' ' LEU . 51.5 t -55.02 -40.82 70.59 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.364 -0.835 . . . . 0.0 109.564 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -29.58 64.75 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.48 -0.763 . . . . 0.0 109.669 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 0.5 OUTLIER -81.83 -12.52 58.46 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.479 -0.763 . . . . 0.0 110.006 179.788 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.419 ' OD1' ' O ' ' A' ' 98' ' ' GLU . 70.4 m-20 -137.15 42.18 2.42 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.309 -0.869 . . . . 0.0 110.047 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -35.67 75.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.272 -0.893 . . . . 0.0 110.237 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.464 ' O ' ' HB ' ' A' ' 105' ' ' THR . 25.4 m-85 -60.97 -25.88 67.16 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.387 -0.821 . . . . 0.0 110.145 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.939 ' O ' HG22 ' A' ' 105' ' ' THR . . . -74.54 -40.82 61.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.332 -0.855 . . . . 0.0 110.159 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.515 HG13 HD23 ' A' ' 130' ' ' LEU . 3.0 t -74.57 -26.52 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.337 -0.852 . . . . 0.0 110.049 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -88.59 -24.02 22.96 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.303 -0.873 . . . . 0.0 110.405 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.939 HG22 ' O ' ' A' ' 102' ' ' ALA . 14.0 t -61.79 -23.75 66.41 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.129 -0.982 . . . . 0.0 110.147 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.759 HD11 HD22 ' A' ' 64' ' ' LEU . 10.6 mt -70.44 -40.44 73.76 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 110.085 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.493 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 110.349 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.6 p . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 121.468 0.651 . . . . 0.0 110.03 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 6.5 t30 -43.29 -45.7 6.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.379 -0.825 . . . . 0.0 110.344 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 1.028 HG22 ' HE1' ' A' ' 78' ' ' MET . 1.2 t -82.2 -37.25 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.196 -0.94 . . . . 0.0 110.059 -179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.493 ' HG3' ' HA ' ' A' ' 107' ' ' LYS . 31.1 ttp180 -53.6 -61.5 2.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.08 -1.012 . . . . 0.0 110.837 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 78.9 mt-10 -65.76 -40.65 92.28 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.351 -0.843 . . . . 0.0 111.259 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.519 ' HG3' ' HB3' ' A' ' 78' ' ' MET . 11.2 tptm -52.68 -51.06 61.89 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.073 -1.017 . . . . 0.0 110.203 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.491 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -58.73 -45.54 89.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.378 -0.826 . . . . 0.0 109.958 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.0 tttm -49.66 -46.41 49.68 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.264 -0.897 . . . . 0.0 109.917 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.64 -51.01 68.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.318 -0.864 . . . . 0.0 110.091 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.928 HD21 ' HG2' ' A' ' 81' ' ' MET . 20.5 tp -47.61 -30.69 3.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.214 -0.929 . . . . 0.0 110.04 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.44 HG23 ' CG1' ' A' ' 103' ' ' VAL . 28.2 t -81.52 -34.76 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.332 -0.855 . . . . 0.0 110.287 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.438 ' O ' ' N ' ' A' ' 134' ' ' LEU . . . -71.52 -60.36 2.27 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.324 -0.86 . . . . 0.0 110.539 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 132' ' ' ALA . 0.8 OUTLIER -42.1 -26.77 0.11 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 110.387 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 1.015 HD11 HD13 ' A' ' 85' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 O-C-N 121.279 -0.888 . . . . 0.0 110.211 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.215 0.531 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.694 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -68.55 -41.04 80.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.272 -0.893 . . . . 0.0 110.191 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.475 ' HG3' HG13 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -55.11 -25.86 34.35 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.281 -0.887 . . . . 0.0 110.248 -180.0 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.475 HG13 ' HG3' ' A' ' 21' ' ' GLU . 40.8 mt -80.47 -44.9 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.258 -0.901 . . . . 0.0 110.273 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.533 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 2.1 mtmm -62.75 -32.18 73.26 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.238 -0.914 . . . . 0.0 110.122 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.852 HG21 ' HA ' ' A' ' 56' ' ' ILE . 33.1 t -71.24 -41.32 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.309 -0.869 . . . . 0.0 110.11 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -56.9 -42.49 79.99 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 110.027 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -72.97 -38.15 66.81 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.376 -0.827 . . . . 0.0 110.056 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.795 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -63.96 -22.16 66.8 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.304 -0.873 . . . . 0.0 110.094 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.88 HG22 ' HA ' ' A' ' 77' ' ' ALA . 13.2 p . . . . . 0 N--CA 1.491 1.613 0 O-C-N 121.259 -0.901 . . . . 0.0 110.17 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.795 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.338 0.589 . . . . 0.0 110.215 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.529 ' CE ' HG22 ' A' ' 79' ' ' THR . 4.2 mmt -86.88 -47.64 8.84 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 110.201 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.485 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 7.2 t -57.87 -19.78 31.88 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.266 -0.896 . . . . 0.0 110.143 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.424 ' OE2' ' HD3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -82.0 -58.13 3.1 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.237 -0.915 . . . . 0.0 110.192 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.653 HG21 HD21 ' A' ' 80' ' ' LEU . 96.4 mt -50.41 -35.56 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.163 -0.961 . . . . 0.0 109.937 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.621 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -67.32 -54.27 22.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.317 -0.864 . . . . 0.0 109.509 179.472 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.1 -21.88 3.65 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.159 -0.963 . . . . 0.0 108.988 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.705 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 14.1 mt -81.73 -37.83 26.68 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.574 -0.704 . . . . 0.0 109.927 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.509 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 80.6 p -49.77 -40.91 42.83 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.071 -1.018 . . . . 0.0 109.243 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.587 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 72.4 m-85 -44.39 -47.09 9.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.233 -0.917 . . . . 0.0 109.317 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.547 ' O ' ' C ' ' A' ' 50' ' ' VAL . 2.8 m120 -70.14 90.71 0.67 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.707 -0.621 . . . . 0.0 110.432 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.547 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.58 -58.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.269 178.099 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.546 ' H ' HG23 ' A' ' 50' ' ' VAL . 2.6 t -61.75 -64.4 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.096 -1.002 . . . . 0.0 109.943 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.705 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.89 -45.24 0.84 Allowed 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.759 -177.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.568 ' CD1' HG22 ' A' ' 92' ' ' VAL . 20.6 t80 -60.99 -53.95 50.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.292 -0.88 . . . . 0.0 110.166 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.52 -30.29 40.82 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.291 -0.88 . . . . 0.0 109.946 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -80.15 -29.38 38.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.428 -0.795 . . . . 0.0 110.01 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.852 ' HA ' HG21 ' A' ' 24' ' ' VAL . 10.3 mt -77.79 -69.63 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.356 -0.84 . . . . 0.0 110.09 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.636 ' HE2' ' HG3' ' A' ' 95' ' ' GLN . 0.2 OUTLIER -45.96 -35.45 4.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.27 -0.894 . . . . 0.0 110.111 179.732 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.5 t -58.36 -66.09 0.54 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.279 -0.888 . . . . 0.0 110.197 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.09 -17.24 16.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.301 -0.875 . . . . 0.0 109.986 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.901 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.7 OUTLIER -79.12 -33.15 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.37 -0.831 . . . . 0.0 109.813 179.809 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.602 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 12.2 m95 -75.74 -41.78 52.39 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.251 -0.905 . . . . 0.0 110.111 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.1 -57.7 11.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.306 -0.871 . . . . 0.0 110.13 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -66.88 -11.57 56.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 110.12 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.923 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 3.7 mt -80.32 -22.19 41.75 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.197 -0.94 . . . . 0.0 110.265 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.9 t30 . . . . . 0 C--N 1.304 -1.377 0 O-C-N 121.243 -0.911 . . . . 0.0 109.966 -179.979 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.468 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 64.9 p-90 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.283 0.563 . . . . 0.0 110.238 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -43.98 -49.84 8.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.257 -0.902 . . . . 0.0 110.108 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -54.08 -49.1 69.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 110.2 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.697 ' CG1' HD13 ' A' ' 106' ' ' LEU . 25.0 t -49.48 -49.95 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.325 -0.86 . . . . 0.0 110.278 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.62 ' CE1' ' CD ' ' A' ' 126' ' ' LYS . 6.7 t80 -47.08 -55.25 8.65 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.284 -0.885 . . . . 0.0 110.586 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.527 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -66.88 -23.86 66.05 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.107 -0.996 . . . . 0.0 110.513 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.923 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -68.89 -68.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.234 -0.916 . . . . 0.0 110.378 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.804 ' HE3' HG23 ' A' ' 123' ' ' VAL . 0.3 OUTLIER -49.63 -31.96 11.93 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.381 -0.824 . . . . 0.0 110.192 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.529 HG22 ' CE ' ' A' ' 40' ' ' MET . 95.7 m -55.27 -56.3 21.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.14 -0.975 . . . . 0.0 109.646 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.901 ' CD2' HD11 ' A' ' 60' ' ' ILE . 29.7 tp -51.6 -66.62 0.35 Allowed 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.329 -0.857 . . . . 0.0 108.818 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.602 ' HE1' ' CZ3' ' A' ' 61' ' ' TRP . 47.3 ttm -41.32 -28.49 0.11 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.444 -0.785 . . . . 0.0 110.418 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.481 ' CB ' HD12 ' A' ' 130' ' ' LEU . 0.2 OUTLIER -72.3 -47.08 52.71 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.21 -0.931 . . . . 0.0 110.529 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.591 ' CE1' HG21 ' A' ' 87' ' ' THR . 33.6 t80 -70.54 -30.53 67.29 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.236 -0.915 . . . . 0.0 111.355 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.933 ' HB2' HG11 ' A' ' 92' ' ' VAL . 6.7 mt -75.26 -33.29 61.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.941 -1.1 . . . . 0.0 110.521 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.025 HG21 HD11 ' A' ' 134' ' ' LEU . 53.7 mt -62.15 -29.76 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 120.995 -1.065 . . . . 0.0 110.352 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.7 tttt -85.89 -71.13 0.55 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.245 -0.909 . . . . 0.0 110.541 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.591 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.0 t -94.34 -20.43 19.76 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.198 -0.938 . . . . 0.0 110.446 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.621 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -49.32 -66.4 2.25 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 3.5 t 171.98 158.21 0.09 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.099 -1.236 . . . . 0.0 110.256 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -63.46 -12.91 35.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.293 -0.879 . . . . 0.0 110.263 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.464 ' HD3' ' O ' ' A' ' 47' ' ' THR . 3.9 ptm85 -84.67 -29.18 25.86 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -0.903 . . . . 0.0 110.237 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.933 HG11 ' HB2' ' A' ' 84' ' ' LEU . 59.9 t -67.65 -31.46 52.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.194 -0.941 . . . . 0.0 109.818 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 83.7 p -80.0 -39.19 30.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.324 -0.86 . . . . 0.0 109.712 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -61.58 -51.23 69.41 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.309 -0.87 . . . . 0.0 109.773 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.636 ' HG3' ' HE2' ' A' ' 57' ' ' MET . 5.3 tp-100 -57.67 -40.1 78.58 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.455 -0.778 . . . . 0.0 109.536 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 8.5 t -55.62 -37.87 68.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -0.873 . . . . 0.0 109.54 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.93 -32.61 67.5 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.437 -0.789 . . . . 0.0 109.705 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -71.16 -24.09 62.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.443 -0.786 . . . . 0.0 109.801 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -123.76 36.04 4.71 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.44 -0.788 . . . . 0.0 110.106 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' MET . . . . . 0.461 ' O ' HG12 ' A' ' 103' ' ' VAL . 0.3 OUTLIER -59.69 -20.67 57.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.333 -0.854 . . . . 0.0 110.271 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.449 ' O ' ' HB ' ' A' ' 105' ' ' THR . 55.1 m-85 -76.24 -28.46 57.16 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.193 -0.942 . . . . 0.0 110.227 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.861 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.71 -39.03 53.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 110.222 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.579 ' CG1' ' N ' ' A' ' 104' ' ' GLN . 3.2 p -74.71 -42.03 47.75 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 CA-C-O 121.942 0.877 . . . . 0.0 109.08 179.559 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.717 ' OE1' HG21 ' A' ' 131' ' ' VAL . 14.3 mm100 -70.04 -21.78 63.15 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.556 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.861 HG22 ' O ' ' A' ' 102' ' ' ALA . 4.7 t -57.47 -16.08 8.64 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.986 -1.072 . . . . 0.0 109.994 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.76 HD11 HD22 ' A' ' 64' ' ' LEU . 76.4 mt -74.99 -37.42 61.87 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.263 -0.898 . . . . 0.0 110.382 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.495 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 2.8 pttp . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.223 -0.923 . . . . 0.0 110.136 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.557 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.4 p . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.64 0.733 . . . . 0.0 109.954 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.557 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 37.8 m-80 -47.77 -60.32 2.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.434 -0.791 . . . . 0.0 110.282 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.804 HG23 ' HE3' ' A' ' 78' ' ' MET . 14.9 p -72.46 -13.09 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.245 -0.909 . . . . 0.0 110.494 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.509 ' HB3' ' HA ' ' A' ' 121' ' ' VAL . 6.4 ttt180 -74.25 -69.02 0.47 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.14 -0.975 . . . . 0.0 110.563 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.46 -34.92 71.39 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.327 -0.858 . . . . 0.0 110.644 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.62 ' CD ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -58.31 -56.56 20.51 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.036 -1.04 . . . . 0.0 109.885 179.978 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.762 ' HB2' ' HE1' ' A' ' 78' ' ' MET . . . -54.5 -44.88 73.1 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 109.93 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.42 ' HE3' ' HD2' ' A' ' 107' ' ' LYS . 11.2 mtpt -57.29 -35.13 69.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.272 -0.893 . . . . 0.0 110.244 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.438 ' O ' ' HB3' ' A' ' 132' ' ' ALA . 5.2 tt0 -59.44 -48.29 82.22 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.295 -0.878 . . . . 0.0 110.422 -179.713 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.589 HD21 ' CD1' ' A' ' 85' ' ' ILE . 3.8 tt -55.19 -51.63 65.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.197 -0.939 . . . . 0.0 110.264 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.717 HG21 ' OE1' ' A' ' 104' ' ' GLN . 96.0 t -63.75 -26.89 41.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.423 -0.798 . . . . 0.0 110.387 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 129' ' ' GLN . . . -64.97 -47.03 79.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.278 -0.889 . . . . 0.0 110.186 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 mt -58.01 -48.87 78.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.265 -0.897 . . . . 0.0 110.406 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 1.025 HD11 HG21 ' A' ' 85' ' ' ILE . 9.6 mp . . . . . 0 N--CA 1.493 1.676 0 O-C-N 121.218 -0.926 . . . . 0.0 110.383 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.431 ' HB2' HD12 ' A' ' 22' ' ' ILE . 2.7 pt-20 . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.298 0.57 . . . . 0.0 110.188 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.85 ' HB2' HD13 ' A' ' 46' ' ' LEU . . . -54.16 -46.12 72.23 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 110.115 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 3.1 pt-20 -41.87 -46.73 4.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.387 -0.821 . . . . 0.0 110.418 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.435 HG13 ' HG3' ' A' ' 21' ' ' GLU . 63.3 mt -63.13 -44.21 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.223 -0.923 . . . . 0.0 110.023 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.526 ' CG ' HD21 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -57.22 -32.74 66.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.289 -0.882 . . . . 0.0 110.103 179.775 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.901 HG22 HD21 ' A' ' 80' ' ' LEU . 28.2 t -71.72 -28.06 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.148 -0.97 . . . . 0.0 110.018 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -45.32 64.04 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.204 -0.935 . . . . 0.0 109.985 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.435 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -78.54 -22.53 47.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.328 -0.857 . . . . 0.0 110.022 179.85 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.457 ' HB2' HD22 ' A' ' 39' ' ' LEU . . . -77.26 -21.98 52.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.294 -0.879 . . . . 0.0 110.218 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.444 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 25.2 p . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.225 -0.922 . . . . 0.0 110.199 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.587 HD22 HD11 ' A' ' 43' ' ' ILE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.22 0.533 . . . . 0.0 110.137 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.555 ' HG2' ' CG ' ' A' ' 83' ' ' TYR . 0.2 OUTLIER -77.97 -56.52 4.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.235 -0.915 . . . . 0.0 110.182 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.7 t -62.73 -29.89 71.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.271 -0.893 . . . . 0.0 110.386 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.47 -60.46 2.3 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.168 -0.957 . . . . 0.0 110.467 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.67 HG21 HD11 ' A' ' 80' ' ' LEU . 15.8 mt -50.39 -31.65 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.222 -0.924 . . . . 0.0 110.301 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.569 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -70.66 -51.31 28.69 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.071 -1.018 . . . . 0.0 109.418 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.499 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.5 OUTLIER -53.96 -20.6 6.43 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.102 -0.999 . . . . 0.0 108.892 178.895 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.85 HD13 ' HB2' ' A' ' 20' ' ' ALA . 20.4 mt -81.13 -37.02 29.54 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.535 -0.728 . . . . 0.0 109.954 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.506 ' O ' ' HB2' ' A' ' 53' ' ' PHE . 80.7 p -53.04 -42.87 66.14 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.099 -1.001 . . . . 0.0 109.099 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.499 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 93.1 m-85 -44.37 -42.22 6.71 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.267 -0.896 . . . . 0.0 109.511 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.532 ' O ' ' N ' ' A' ' 51' ' ' VAL . 5.3 m-80 -73.19 92.64 1.76 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.483 -0.761 . . . . 0.0 110.187 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.526 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.39 -57.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.657 178.343 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.542 HG12 ' N ' ' A' ' 52' ' ' ALA . 3.0 t -65.82 -66.38 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.963 -1.086 . . . . 0.0 110.482 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.725 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -36.01 -45.31 0.42 Allowed 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.161 0.505 . . . . 0.0 111.08 -177.582 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.636 ' CD1' HG22 ' A' ' 92' ' ' VAL . 6.0 t80 -55.68 -58.85 6.08 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.307 -0.871 . . . . 0.0 110.393 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.486 ' O ' ' HB2' ' A' ' 58' ' ' SER . 18.2 m -51.1 -42.03 60.38 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.165 -0.959 . . . . 0.0 110.44 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 1.5 mm-40 -66.33 -30.96 71.48 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.198 -0.939 . . . . 0.0 110.505 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.744 ' HA ' HG21 ' A' ' 24' ' ' VAL . 7.1 mt -74.23 -70.01 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.334 -0.854 . . . . 0.0 110.359 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.419 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 52.6 mmm -46.7 -38.27 9.62 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.131 -0.981 . . . . 0.0 110.128 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.486 ' HB2' ' O ' ' A' ' 54' ' ' SER . 23.2 t -52.7 -60.68 2.96 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.252 -0.905 . . . . 0.0 110.26 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.55 ' HB3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -58.23 -31.47 67.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.142 -0.974 . . . . 0.0 109.858 179.793 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.7 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -66.92 -29.59 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.411 -0.806 . . . . 0.0 109.917 179.883 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.548 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 19.7 m95 -79.39 -41.67 27.22 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.247 -0.908 . . . . 0.0 110.434 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.53 -66.3 0.46 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.249 -0.907 . . . . 0.0 110.636 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -61.37 -23.9 66.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.916 . . . . 0.0 110.606 -179.602 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.868 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 3.8 mt -60.78 -27.34 67.92 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.151 -0.968 . . . . 0.0 110.337 -179.732 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.5 t30 . . . . . 0 C--N 1.303 -1.432 0 O-C-N 121.286 -0.883 . . . . 0.0 110.014 179.96 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.55 ' HB2' HG21 ' A' ' 123' ' ' VAL . 33.1 p-90 . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.281 0.562 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -45.92 -46.76 16.24 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.298 -0.876 . . . . 0.0 110.285 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -59.81 -40.01 86.98 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.234 -0.916 . . . . 0.0 110.258 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.837 HG12 ' HE2' ' A' ' 78' ' ' MET . 49.6 t -62.02 -57.32 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.172 -0.955 . . . . 0.0 110.272 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 74' ' ' VAL . 4.6 t80 -42.38 -54.54 3.76 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.299 -0.875 . . . . 0.0 110.315 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.444 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -61.11 -36.69 80.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.19 -0.944 . . . . 0.0 110.263 179.932 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.868 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -62.41 -25.87 68.18 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.235 -0.916 . . . . 0.0 110.159 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.837 ' HE2' HG12 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -78.57 -35.32 46.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.198 -0.939 . . . . 0.0 110.177 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 25.6 m -60.26 -55.26 35.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 0.0 109.997 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.901 HD21 HG22 ' A' ' 24' ' ' VAL . 25.5 tp -59.91 -34.63 73.46 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.456 -0.778 . . . . 0.0 109.964 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.65 ' CE ' HD11 ' A' ' 64' ' ' LEU . 15.9 ttm -66.39 -33.74 76.4 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.137 -0.977 . . . . 0.0 110.122 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.746 ' HB2' HD12 ' A' ' 130' ' ' LEU . 3.7 tp10 -77.74 -63.83 1.29 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.295 -0.878 . . . . 0.0 110.144 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.742 ' CE1' HG21 ' A' ' 87' ' ' THR . 54.0 t80 -41.27 -49.65 3.66 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.418 -0.801 . . . . 0.0 110.641 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.535 ' CB ' HG11 ' A' ' 92' ' ' VAL . 81.6 mt -64.72 -43.78 92.32 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.311 -0.868 . . . . 0.0 110.337 -179.452 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.931 HD11 ' SG ' ' A' ' 96' ' ' CYS . 13.5 mt -49.69 -25.98 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.086 -1.009 . . . . 0.0 109.768 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.8 mttp -97.18 -81.36 0.43 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 110.053 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.742 HG21 ' CE1' ' A' ' 83' ' ' TYR . 13.0 t -72.64 -24.67 61.08 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.301 -0.874 . . . . 0.0 110.271 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.445 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -47.22 -77.23 0.11 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.451 ' HB3' HG23 ' A' ' 92' ' ' VAL . 26.7 t -179.17 155.98 0.75 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.159 -1.2 . . . . 0.0 110.326 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -56.91 -17.79 10.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.288 -0.882 . . . . 0.0 110.177 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -83.25 -37.07 24.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.323 -0.86 . . . . 0.0 110.175 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.636 HG22 ' CD1' ' A' ' 53' ' ' PHE . 59.2 t -59.92 -32.14 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.292 -0.88 . . . . 0.0 110.085 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.0 t -79.01 -40.75 30.63 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.0 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.527 ' O ' ' CG ' ' A' ' 97' ' ' LYS . 38.9 mt-30 -65.58 -26.14 67.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 109.867 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -35.91 60.91 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.244 -0.91 . . . . 0.0 109.519 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' CYS . . . . . 0.931 ' SG ' HD11 ' A' ' 85' ' ' ILE . 1.3 m -65.61 -37.9 87.92 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.33 -0.856 . . . . 0.0 109.669 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.527 ' CG ' ' O ' ' A' ' 94' ' ' GLN . 0.2 OUTLIER -72.8 -28.14 62.4 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.339 -0.851 . . . . 0.0 109.596 179.349 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.507 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 7.7 mm-40 -75.32 -29.99 60.17 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.368 -0.832 . . . . 0.0 109.348 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.408 ' OD1' ' HB2' ' A' ' 102' ' ' ALA . 22.1 t-20 -116.66 44.38 2.04 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.502 -0.749 . . . . 0.0 109.583 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -29.27 69.78 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.431 -0.793 . . . . 0.0 110.259 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.483 ' O ' ' HB ' ' A' ' 105' ' ' THR . 57.9 m-85 -66.44 -24.92 66.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.205 -0.934 . . . . 0.0 109.779 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.898 ' O ' HG22 ' A' ' 105' ' ' THR . . . -77.47 -41.32 39.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.462 -0.774 . . . . 0.0 110.112 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.599 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 4.0 t -72.33 -31.01 37.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.356 -0.84 . . . . 0.0 110.156 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.497 ' O ' ' CG ' ' A' ' 107' ' ' LYS . 2.2 mm100 -86.91 -19.41 28.89 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 110.426 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.898 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.6 t -54.7 -18.9 5.17 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.931 . . . . 0.0 109.927 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.619 HD22 HG11 ' A' ' 74' ' ' VAL . 91.3 mt -79.41 -35.65 40.31 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.389 -0.819 . . . . 0.0 110.118 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.593 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.263 -0.898 . . . . 0.0 110.32 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.558 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.3 p . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 121.388 0.613 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.558 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 6.0 t30 -39.19 -31.77 0.08 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.66 -0.65 . . . . 0.0 110.361 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.629 HG13 ' HE1' ' A' ' 78' ' ' MET . 2.3 t -83.49 -52.62 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.304 -0.872 . . . . 0.0 109.93 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.593 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 4.4 mtp180 -44.79 -43.67 8.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.142 -0.974 . . . . 0.0 111.176 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -79.33 -46.15 18.25 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.195 -0.94 . . . . 0.0 111.769 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LYS . . . . . 0.543 ' CD ' ' HB2' ' A' ' 78' ' ' MET . 0.0 OUTLIER -53.66 -54.92 30.88 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.919 -1.113 . . . . 0.0 110.109 -179.511 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.81 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -55.46 -44.22 76.21 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.437 -0.789 . . . . 0.0 110.396 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -58.85 -34.66 71.83 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.168 -0.958 . . . . 0.0 110.5 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -69.41 -53.54 18.85 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.227 -0.921 . . . . 0.0 110.78 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.762 HD21 ' CD1' ' A' ' 85' ' ' ILE . 3.3 tt -47.35 -33.66 6.06 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.09 -1.006 . . . . 0.0 110.416 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.486 HG21 ' HG2' ' A' ' 104' ' ' GLN . 44.8 t -77.26 -35.38 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.252 -0.905 . . . . 0.0 110.333 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.19 -49.53 75.7 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -0.91 . . . . 0.0 110.694 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.1 mt -60.93 -56.83 16.52 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.157 -0.965 . . . . 0.0 110.467 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.821 HD11 HD13 ' A' ' 85' ' ' ILE . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.18 -0.95 . . . . 0.0 110.284 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.61 -61.1 1.02 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.204 -1.174 . . . . 0.0 110.219 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 19.6 t -103.76 -28.14 11.83 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.263 -0.898 . . . . 0.0 110.196 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -105.74 173.62 6.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.253 -0.904 . . . . 0.0 110.171 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.66 116.66 18.38 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.162 -0.962 . . . . 0.0 110.291 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.38 132.12 20.4 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.275 -0.891 . . . . 0.0 110.104 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 55.0 m -111.64 -50.25 2.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -0.911 . . . . 0.0 110.309 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.89 105.75 0.34 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.211 -0.93 . . . . 0.0 110.272 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 6' ' ' LEU . 1.3 m -59.1 -64.06 1.08 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.274 -0.891 . . . . 0.0 110.199 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.433 ' CB ' ' O ' ' A' ' 5' ' ' SER . 0.6 OUTLIER 64.83 149.7 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.217 -0.927 . . . . 0.0 110.223 179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.82 -83.75 0.65 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.216 -0.928 . . . . 0.0 110.182 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.09 157.93 44.85 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -112.48 167.96 10.03 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.266 -0.896 . . . . 0.0 110.22 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 8.5 mmm -80.79 -157.06 0.15 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.249 -0.907 . . . . 0.0 110.166 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.79 -152.41 0.05 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.192 -0.942 . . . . 0.0 110.185 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.99 -170.49 1.97 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.216 -0.927 . . . . 0.0 110.286 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.2 mm -67.87 134.98 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.301 -0.875 . . . . 0.0 110.194 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.9 t -75.38 116.89 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.206 -0.934 . . . . 0.0 110.221 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 20.6 p-80 -63.75 -13.3 42.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.265 -0.897 . . . . 0.0 110.176 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -101.13 77.93 1.86 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 110.209 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -45.76 109.1 0.15 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.255 -0.903 . . . . 0.0 110.117 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.19 66.32 1.34 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.259 -0.901 . . . . 0.0 110.249 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -122.23 19.38 10.67 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.193 -0.942 . . . . 0.0 110.222 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.721 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -68.37 -52.31 34.57 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.237 -0.914 . . . . 0.0 110.309 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.438 ' C ' ' O ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -41.05 -34.03 0.39 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.287 -0.883 . . . . 0.0 110.601 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.1 mm -77.88 -41.86 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.095 -1.003 . . . . 0.0 109.964 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.534 ' HE2' ' CG ' ' A' ' 42' ' ' GLU . 13.3 tptt -61.55 -58.65 7.26 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.253 -0.904 . . . . 0.0 109.934 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.868 HG21 ' HA ' ' A' ' 56' ' ' ILE . 53.7 t -45.45 -55.11 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.407 -0.808 . . . . 0.0 110.385 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.405 ' HG3' ' NH2' ' A' ' 63' ' ' ARG . 18.8 ttt180 -52.69 -63.36 1.17 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.913 . . . . 0.0 110.653 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -14.05 5.44 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.401 -0.812 . . . . 0.0 110.714 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.923 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -86.55 -33.44 20.25 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.134 -0.979 . . . . 0.0 110.328 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.519 ' CA ' ' HB3' ' A' ' 76' ' ' LYS . 19.8 p -91.61 18.74 7.06 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.288 -0.883 . . . . 0.0 110.119 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.462 ' HB2' ' O ' ' A' ' 28' ' ' THR . 20.3 t 178.28 105.68 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.3 -0.875 . . . . 0.0 110.159 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.407 ' O ' ' C ' ' A' ' 31' ' ' ASP . 2.2 t-20 -109.07 37.39 2.58 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.269 -0.894 . . . . 0.0 110.19 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.584 ' CB ' ' CD ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER -44.26 -60.93 2.37 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.2 -0.938 . . . . 0.0 110.224 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.584 ' CD ' ' CB ' ' A' ' 31' ' ' ASP . 24.2 Cg_endo -68.27 -162.9 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.684 0 O-C-N 123.911 1.48 . . . . 0.0 110.301 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 2.4 m95 -112.41 -164.43 0.92 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.227 -0.921 . . . . 0.0 110.6 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 141.03 -167.3 25.72 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -63.81 144.03 87.64 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 O-C-N 124.011 1.532 . . . . 0.0 110.272 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.6 t -129.37 60.86 1.55 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.912 . . . . 0.0 110.344 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -101.74 -71.54 0.71 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.141 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.461 ' HB3' ' HB3' ' A' ' 41' ' ' SER . 0.2 OUTLIER -163.65 67.31 0.18 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.191 -0.943 . . . . 0.0 110.241 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.923 HD23 ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -57.33 -43.87 83.72 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.224 -0.922 . . . . 0.0 110.231 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.405 ' HA ' HD12 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -55.18 -45.02 75.76 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.131 -0.98 . . . . 0.0 110.141 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.461 ' HB3' ' HB3' ' A' ' 38' ' ' SER . 15.6 t -59.72 -29.59 68.22 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.331 -0.855 . . . . 0.0 110.272 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.534 ' CG ' ' HE2' ' A' ' 23' ' ' LYS . 22.0 mm-40 -70.43 -52.06 24.92 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.255 -0.903 . . . . 0.0 110.286 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.774 HD13 ' CD1' ' A' ' 80' ' ' LEU . 7.2 mt -54.24 -35.54 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.183 -0.948 . . . . 0.0 109.992 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.665 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -67.78 -52.21 39.81 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.31 -0.869 . . . . 0.0 109.486 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.485 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 10.8 t0 -53.91 -20.23 5.74 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.087 -1.008 . . . . 0.0 109.187 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.721 HD22 ' HB2' ' A' ' 20' ' ' ALA . 8.5 mt -82.7 -38.11 23.83 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.523 -0.736 . . . . 0.0 110.093 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.532 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 72.3 p -51.82 -42.5 62.56 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.243 -0.911 . . . . 0.0 109.377 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.547 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 86.3 m-85 -43.63 -44.56 6.4 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.712 -0.795 . . . . 0.0 109.259 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.463 ' O ' ' O ' ' A' ' 48' ' ' TYR . 2.4 t-20 -56.68 -157.48 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.865 0.84 . . . . 0.0 110.298 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.6 t -125.97 -34.56 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -178.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.559 HG12 ' N ' ' A' ' 52' ' ' ALA . 11.2 t -84.54 -71.91 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 CA-C-O 121.967 0.889 . . . . 0.0 109.84 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.559 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -37.92 -40.79 0.49 Allowed 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.737 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.653 ' HA ' HD12 ' A' ' 56' ' ' ILE . 8.1 t80 -54.54 -56.4 19.33 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.425 -0.797 . . . . 0.0 110.214 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 58' ' ' SER . 3.5 m -58.87 -34.96 72.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.301 -0.874 . . . . 0.0 110.251 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.65 -20.02 60.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.279 -0.888 . . . . 0.0 110.04 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.868 ' HA ' HG21 ' A' ' 24' ' ' VAL . 36.6 mt -80.96 -70.07 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 110.135 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.5 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 70.5 mmm -52.01 -36.06 48.72 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.25 -0.906 . . . . 0.0 109.909 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 54' ' ' SER . 3.5 m -57.02 -62.69 1.57 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.308 -0.87 . . . . 0.0 110.147 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -25.32 61.06 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 109.894 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.823 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -72.86 -31.34 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.384 -0.823 . . . . 0.0 109.789 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.57 ' CH2' ' SD ' ' A' ' 81' ' ' MET . 14.9 m95 -72.9 -39.84 66.03 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.274 -0.892 . . . . 0.0 110.307 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -58.9 5.81 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.89 . . . . 0.0 110.211 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.405 ' NH2' ' HG3' ' A' ' 25' ' ' ARG . 18.3 mmt180 -63.58 -11.76 27.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.283 -0.885 . . . . 0.0 110.255 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.995 HD22 HD11 ' A' ' 106' ' ' LEU . 4.7 mt -80.17 -24.97 40.0 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.299 -0.876 . . . . 0.0 110.337 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.458 ' O ' ' O ' ' A' ' 66' ' ' ASP . 49.4 t-20 -111.31 42.44 1.67 Allowed 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.352 -0.842 . . . . 0.0 109.949 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.458 ' O ' ' O ' ' A' ' 65' ' ' ASN . 0.1 OUTLIER -52.4 -169.42 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.423 -0.798 . . . . 0.0 110.6 -179.756 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -86.44 -178.43 6.43 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.458 -0.776 . . . . 0.0 110.277 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -91.17 54.07 3.22 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -144.96 -37.15 0.29 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.374 -1.074 . . . . 0.0 110.293 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -135.68 79.78 1.8 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.233 -0.917 . . . . 0.0 110.303 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.474 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 69.3 p-90 -71.53 -2.95 18.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.311 -0.868 . . . . 0.0 110.178 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -48.21 -45.53 34.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.206 -0.934 . . . . 0.0 109.985 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.408 ' ND1' ' N ' ' A' ' 73' ' ' HIS . 2.8 m-70 -61.64 -36.57 81.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.311 -0.868 . . . . 0.0 109.924 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.68 HG22 ' O ' ' A' ' 64' ' ' LEU . 16.4 t -63.1 -57.24 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.304 -0.873 . . . . 0.0 110.021 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.585 ' CE1' ' HD3' ' A' ' 126' ' ' LYS . 7.0 t80 -49.2 -49.11 44.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 109.928 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.519 ' HB3' ' CA ' ' A' ' 28' ' ' THR . 4.5 tptt -62.07 -31.85 72.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.339 -0.851 . . . . 0.0 109.843 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.809 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -69.96 -28.02 65.21 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.349 -0.844 . . . . 0.0 109.908 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.562 ' HG2' HD21 ' A' ' 64' ' ' LEU . 0.7 OUTLIER -73.34 -30.83 63.6 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.387 -0.82 . . . . 0.0 110.183 179.862 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.4 m -70.79 -36.66 73.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.214 -0.929 . . . . 0.0 109.97 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.823 ' CD2' HD11 ' A' ' 60' ' ' ILE . 42.0 tp -77.11 -31.4 55.8 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.318 -0.864 . . . . 0.0 109.677 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.57 ' SD ' ' CH2' ' A' ' 61' ' ' TRP . 31.0 ttp -76.71 -28.12 55.74 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.395 -0.815 . . . . 0.0 109.882 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.548 ' HB2' HD11 ' A' ' 130' ' ' LEU . 26.9 tt0 -85.33 -34.97 21.72 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.262 -0.899 . . . . 0.0 110.026 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.405 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 31.8 t80 -70.58 -45.34 65.57 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.309 -0.87 . . . . 0.0 110.257 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.581 HD11 HG21 ' A' ' 43' ' ' ILE . 50.7 mt -67.46 -40.41 85.36 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.274 -0.892 . . . . 0.0 110.16 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.933 HD13 HD11 ' A' ' 134' ' ' LEU . 26.5 mt -56.75 -20.72 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 109.973 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 -82.4 0.41 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.24 -0.913 . . . . 0.0 110.013 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.422 HG23 ' HB1' ' A' ' 44' ' ' ALA . 7.6 t -76.6 -25.9 54.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.293 -0.879 . . . . 0.0 110.149 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.665 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -44.24 -69.58 0.69 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.434 ' HB3' ' HG2' ' A' ' 91' ' ' ARG . 0.1 OUTLIER 176.61 176.16 0.31 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.224 -1.162 . . . . 0.0 110.215 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -79.12 -15.18 58.51 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 110.257 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.451 ' HD3' ' O ' ' A' ' 47' ' ' THR . 2.2 ptm180 -82.84 -28.59 30.02 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.132 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.5 HG21 HG21 ' A' ' 47' ' ' THR . 95.0 t -69.25 -31.18 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.198 -0.938 . . . . 0.0 109.628 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 85' ' ' ILE . 74.5 m -78.81 -35.85 43.58 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.308 -0.87 . . . . 0.0 109.623 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.58 -41.11 98.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.381 -0.824 . . . . 0.0 109.714 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.21 -35.71 81.9 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.442 -0.786 . . . . 0.0 109.489 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.918 ' SG ' HD13 ' A' ' 134' ' ' LEU . 35.2 t -60.14 -39.8 87.6 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.436 -0.79 . . . . 0.0 109.676 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -33.09 69.24 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.437 -0.789 . . . . 0.0 109.776 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -78.15 -17.73 56.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.389 -0.819 . . . . 0.0 109.903 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -124.45 37.97 4.29 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.46 -0.775 . . . . 0.0 109.928 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -60.19 -29.06 68.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.307 -0.871 . . . . 0.0 110.192 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -64.89 -28.06 69.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.274 -0.892 . . . . 0.0 109.899 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.982 ' O ' HG22 ' A' ' 105' ' ' THR . . . -75.68 -42.79 50.21 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.378 -0.826 . . . . 0.0 110.042 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.543 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 3.3 t -71.75 -26.56 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.344 -0.847 . . . . 0.0 110.175 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -85.31 -27.72 25.75 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.329 -0.857 . . . . 0.0 110.311 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.982 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.4 t -56.58 -17.0 7.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.313 -0.867 . . . . 0.0 110.037 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.995 HD11 HD22 ' A' ' 64' ' ' LEU . 17.4 mt -80.12 -40.73 26.87 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.286 -0.884 . . . . 0.0 110.097 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 124' ' ' ARG . 13.6 ttpt -50.49 -30.69 13.44 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.217 -0.927 . . . . 0.0 110.077 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.409 ' OD2' ' HA ' ' A' ' 105' ' ' THR . 2.1 p30 -98.74 -19.23 17.58 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.314 -0.866 . . . . 0.0 110.197 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -59.02 90.24 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.288 -0.883 . . . . 0.0 110.145 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 110' ' ' GLN . 9.1 pt20 -124.65 124.37 42.04 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.357 -0.839 . . . . 0.0 110.131 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -152.95 137.48 16.79 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.214 -0.929 . . . . 0.0 110.273 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.612 ' O ' HG12 ' A' ' 112' ' ' VAL . 47.7 t -138.48 40.76 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.076 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.458 ' HB2' ' O ' ' A' ' 112' ' ' VAL . 11.6 m-20 56.95 172.47 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.319 -0.863 . . . . 0.0 110.224 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -42.95 27.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.224 -0.923 . . . . 0.0 110.311 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -153.12 100.6 2.49 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.272 -0.893 . . . . 0.0 110.108 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -142.91 -149.51 5.14 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.428 ' O ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -111.88 149.75 31.41 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.273 -1.133 . . . . 0.0 110.195 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -81.26 84.66 6.54 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.273 -0.892 . . . . 0.0 110.233 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -118.24 17.26 13.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.261 -0.899 . . . . 0.0 110.212 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.455 ' O ' HG12 ' A' ' 123' ' ' VAL . . . -97.34 31.61 7.57 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.56 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.3 p -89.04 -44.83 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.244 -1.15 . . . . 0.0 110.169 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.56 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.9 OUTLIER -44.41 -37.17 3.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.367 -0.833 . . . . 0.0 109.9 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.613 ' CG2' HG12 ' A' ' 74' ' ' VAL . 8.5 p -79.75 -38.01 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.509 ' N ' HG13 ' A' ' 123' ' ' VAL . 5.1 ttp180 -54.9 -55.41 30.82 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.242 -0.911 . . . . 0.0 110.394 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -67.94 -28.68 67.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.411 -0.806 . . . . 0.0 110.529 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.585 ' HD3' ' CE1' ' A' ' 75' ' ' TYR . 2.3 tptt -60.51 -58.77 7.09 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.179 -0.951 . . . . 0.0 109.899 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.543 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -54.99 -42.67 72.77 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.395 -0.816 . . . . 0.0 110.099 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.67 -35.34 74.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.244 -0.91 . . . . 0.0 110.165 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -65.13 -52.64 54.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.3 -0.875 . . . . 0.0 110.464 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.97 ' O ' HD12 ' A' ' 134' ' ' LEU . 0.1 OUTLIER -48.54 -39.56 23.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.218 -0.926 . . . . 0.0 110.443 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 11.8 t -77.32 -30.8 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.231 -0.918 . . . . 0.0 110.323 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.25 -56.67 12.98 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.204 -0.935 . . . . 0.0 110.172 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.4 mp -58.96 -53.12 61.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.263 -0.898 . . . . 0.0 110.31 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.97 HD12 ' O ' ' A' ' 130' ' ' LEU . 0.8 OUTLIER -55.27 -18.04 5.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.197 -0.939 . . . . 0.0 110.156 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -155.96 88.46 1.11 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.277 -0.89 . . . . 0.0 110.035 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -77.63 -52.15 9.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.219 -0.926 . . . . 0.0 110.521 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -120.93 150.95 40.29 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.193 -0.942 . . . . 0.0 110.343 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -122.71 146.69 47.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.301 -0.874 . . . . 0.0 110.02 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.455 ' O ' ' O ' ' A' ' 140' ' ' LEU . 7.3 mmm180 -93.87 69.91 3.99 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.243 -0.911 . . . . 0.0 110.494 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' A' ' 139' ' ' ARG . 0.1 OUTLIER 55.04 108.97 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.248 -0.908 . . . . 0.0 110.279 179.874 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 5.9 ttt85 -69.67 -162.16 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.221 -0.924 . . . . 0.0 110.221 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -175.25 65.03 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.269 -0.895 . . . . 0.0 110.202 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.61 126.44 55.01 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.284 -0.885 . . . . 0.0 110.152 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.192 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 13.5 t -144.3 48.14 1.38 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.19 -1.183 . . . . 0.0 110.177 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 20.9 m -54.85 149.22 11.74 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.131 -0.98 . . . . 0.0 110.143 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -106.0 121.78 44.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.232 -0.917 . . . . 0.0 110.259 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -110.7 149.52 30.36 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.212 -0.93 . . . . 0.0 110.058 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.63 17.88 14.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.188 -0.945 . . . . 0.0 110.063 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.8 t -58.15 147.04 31.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.231 -0.918 . . . . 0.0 110.254 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.8 m -97.99 9.48 42.68 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.168 -0.957 . . . . 0.0 110.13 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.5 t 49.06 -141.98 0.6 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.298 -0.876 . . . . 0.0 110.185 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.401 ' HA ' HD22 ' A' ' 6' ' ' LEU . 1.6 mm? 53.97 24.01 4.36 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.29 -0.881 . . . . 0.0 110.228 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.469 ' O ' ' HD3' ' A' ' 8' ' ' ARG . 59.8 mtt180 -117.94 -171.92 2.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.278 -0.889 . . . . 0.0 110.272 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.469 ' HD3' ' O ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -152.3 -179.5 7.6 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.245 -0.909 . . . . 0.0 110.243 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.8 mm-40 -100.05 -45.67 5.59 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.242 -0.911 . . . . 0.0 110.23 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.412 ' C ' ' HG3' ' A' ' 11' ' ' LYS . 16.9 mtt -118.88 151.85 37.36 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.189 -0.944 . . . . 0.0 110.166 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.412 ' HG3' ' C ' ' A' ' 10' ' ' MET . 1.8 mttt -135.49 -58.49 0.78 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.268 -0.895 . . . . 0.0 110.305 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -119.52 96.33 5.16 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.25 -0.907 . . . . 0.0 110.206 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 mp -78.64 137.21 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.229 -0.92 . . . . 0.0 110.138 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.4 p -93.63 158.03 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.253 -0.904 . . . . 0.0 110.341 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -73.94 -34.85 64.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.228 -0.92 . . . . 0.0 110.298 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.8 m-20 -126.94 95.75 4.41 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -0.954 . . . . 0.0 110.4 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.526 ' O ' ' CD1' ' A' ' 17' ' ' TYR . 15.1 p90 -55.97 145.85 24.06 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.314 -0.866 . . . . 0.0 110.108 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.438 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 14.5 m -96.16 7.68 45.79 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.163 -0.961 . . . . 0.0 110.257 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 18' ' ' SER . 6.1 mm-40 56.52 16.2 2.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.294 -0.879 . . . . 0.0 110.305 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.752 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -79.13 -48.74 13.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -0.884 . . . . 0.0 110.12 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.498 ' CG ' HG13 ' A' ' 22' ' ' ILE . 9.5 pt-20 -47.51 -32.31 5.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.342 -0.849 . . . . 0.0 110.241 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.498 HG13 ' CG ' ' A' ' 21' ' ' GLU . 28.8 mt -80.25 -43.6 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.258 -0.901 . . . . 0.0 110.172 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.615 ' O ' HD11 ' A' ' 43' ' ' ILE . 5.5 mmtm -57.64 -30.46 65.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.256 -0.902 . . . . 0.0 110.193 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.879 HG22 HD21 ' A' ' 80' ' ' LEU . 44.2 t -77.94 -46.92 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.242 -0.911 . . . . 0.0 110.119 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.85 -39.7 26.68 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.336 -0.852 . . . . 0.0 110.102 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -76.29 -37.96 56.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.398 -0.814 . . . . 0.0 110.121 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 1.024 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -65.49 -13.26 58.44 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.322 -0.861 . . . . 0.0 109.964 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.584 ' HA ' ' CB ' ' A' ' 76' ' ' LYS . 8.5 p -103.8 -28.42 11.64 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.284 -0.885 . . . . 0.0 110.188 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.5 m -76.16 -79.51 0.1 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.321 -0.862 . . . . 0.0 110.245 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -168.52 -179.05 3.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.22 -0.925 . . . . 0.0 110.163 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -153.8 146.32 17.44 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.279 -0.888 . . . . 0.0 110.369 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.577 ' O ' ' CE3' ' A' ' 33' ' ' TRP . 18.1 Cg_endo -65.32 -158.65 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 124.091 1.574 . . . . 0.0 110.254 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.577 ' CE3' ' O ' ' A' ' 32' ' ' PRO . 0.5 OUTLIER -144.4 -178.73 6.13 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.204 -0.935 . . . . 0.0 110.674 -179.916 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.61 -111.31 4.17 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -65.54 -165.0 0.07 OUTLIER 'Trans proline' 0 C--N 1.307 -1.64 0 O-C-N 123.862 1.454 . . . . 0.0 110.352 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.6 p -101.08 149.56 23.83 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.225 -0.922 . . . . 0.0 110.329 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -99.77 -28.9 12.92 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.251 -0.905 . . . . 0.0 110.323 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 53.51 63.63 2.14 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.143 -0.973 . . . . 0.0 110.283 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.024 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -119.39 -25.27 6.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.191 -0.943 . . . . 0.0 110.212 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.1 ttt -71.95 -60.54 2.18 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.29 -0.882 . . . . 0.0 110.18 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.407 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 82.7 p -53.84 -25.27 18.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.254 -0.904 . . . . 0.0 110.064 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -75.54 -53.17 9.05 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 110.114 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.865 HG21 HD11 ' A' ' 80' ' ' LEU . 59.3 mt -54.71 -35.3 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.297 -0.877 . . . . 0.0 110.134 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.659 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -71.75 -49.98 34.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.221 -0.924 . . . . 0.0 109.548 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.424 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 2.9 m-20 -53.29 -21.13 5.03 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.059 -1.025 . . . . 0.0 108.827 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.792 ' HB3' HD11 ' A' ' 56' ' ' ILE . 14.8 mt -79.25 -38.21 36.12 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.621 -0.674 . . . . 0.0 109.852 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.516 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 72.7 p -51.91 -43.76 63.53 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.103 -0.998 . . . . 0.0 109.156 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.43 ' CE2' ' O ' ' A' ' 87' ' ' THR . 87.5 m-85 -44.67 -42.99 7.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.285 -0.884 . . . . 0.0 109.578 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.543 ' O ' ' C ' ' A' ' 50' ' ' VAL . 14.7 m-20 -72.96 90.65 1.49 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.469 -0.77 . . . . 0.0 110.348 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.543 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.2 -59.04 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.25 178.295 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.535 ' H ' HG23 ' A' ' 50' ' ' VAL . 2.6 t -62.98 -64.17 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.09 -1.006 . . . . 0.0 110.1 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.79 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.81 -47.48 1.02 Allowed 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 121.171 0.51 . . . . 0.0 110.846 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.552 ' CZ ' ' OE1' ' A' ' 95' ' ' GLN . 9.7 t80 -56.36 -54.28 47.4 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.292 -0.88 . . . . 0.0 110.289 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.06 -27.59 54.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.219 -0.926 . . . . 0.0 110.196 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -82.92 -25.31 32.54 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.301 -0.874 . . . . 0.0 110.208 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.792 HD11 ' HB3' ' A' ' 46' ' ' LEU . 8.7 mt -79.21 -69.96 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.361 -0.837 . . . . 0.0 109.945 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.535 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 52.0 mmm -45.85 -37.69 6.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.155 -0.966 . . . . 0.0 109.745 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.3 t -55.19 -61.44 2.33 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.347 -0.845 . . . . 0.0 109.893 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.413 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -59.21 -21.45 59.52 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.153 -0.967 . . . . 0.0 109.859 179.689 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.677 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -76.24 -30.77 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.375 -0.828 . . . . 0.0 109.768 179.781 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 57' ' ' MET . 30.2 m95 -77.51 -51.0 11.45 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.891 . . . . 0.0 110.022 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.98 -51.77 49.41 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.241 -0.912 . . . . 0.0 109.969 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -69.01 -24.25 64.19 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.265 -0.897 . . . . 0.0 110.094 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 1.04 HD22 HD11 ' A' ' 106' ' ' LEU . 4.5 mt -71.07 -25.54 62.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.425 -0.797 . . . . 0.0 110.314 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.597 ' O ' ' ND2' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -99.66 35.27 2.03 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.307 -0.871 . . . . 0.0 109.89 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.507 ' HB2' HG23 ' A' ' 74' ' ' VAL . 6.2 m-20 -79.15 142.83 36.03 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.415 -0.803 . . . . 0.0 110.159 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.482 ' HB3' ' CZ ' ' A' ' 109' ' ' PHE . 19.0 p80 -161.23 164.3 30.47 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.598 -0.688 . . . . 0.0 110.181 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.59 -58.77 2.98 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.29 -88.56 0.09 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.351 -1.088 . . . . 0.0 110.097 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -146.57 143.1 28.63 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.225 -0.922 . . . . 0.0 110.16 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.461 ' CE3' ' HB2' ' A' ' 75' ' ' TYR . 51.7 p-90 -77.11 1.87 16.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.321 -0.862 . . . . 0.0 110.227 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' A' ' 71' ' ' TRP . 42.7 mtt-85 -43.18 -41.92 3.96 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.315 -0.866 . . . . 0.0 110.404 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.1 m-70 -68.0 -43.84 77.97 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.107 -0.996 . . . . 0.0 110.248 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.685 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 70.5 t -56.08 -51.49 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.253 -0.904 . . . . 0.0 110.297 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.497 ' HB2' HG23 ' A' ' 123' ' ' VAL . 6.1 t80 -49.78 -64.56 0.77 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.141 -0.974 . . . . 0.0 109.975 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.584 ' CB ' ' HA ' ' A' ' 28' ' ' THR . 1.1 mmpt? -55.21 -21.7 14.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.327 -0.858 . . . . 0.0 110.044 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.907 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -69.79 -37.97 76.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.182 -0.949 . . . . 0.0 110.186 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.715 ' HE1' HG22 ' A' ' 123' ' ' VAL . 2.8 mpp? -68.39 -41.67 80.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.361 -0.837 . . . . 0.0 110.195 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.6 m -58.41 -45.99 87.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -0.889 . . . . 0.0 110.399 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.879 HD21 HG22 ' A' ' 24' ' ' VAL . 18.2 tp -58.45 -60.27 4.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.268 -0.895 . . . . 0.0 109.926 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.442 ' O ' HG13 ' A' ' 85' ' ' ILE . 28.1 ttm -53.78 -21.97 8.45 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.204 -0.935 . . . . 0.0 110.101 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.447 ' N ' HD11 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -79.89 -37.89 33.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.236 -0.915 . . . . 0.0 110.716 -179.751 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.722 ' O ' HG22 ' A' ' 87' ' ' THR . 32.3 t80 -81.0 -22.66 39.25 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.238 -0.914 . . . . 0.0 110.784 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.728 ' HB2' HG11 ' A' ' 92' ' ' VAL . 48.2 mt -85.17 -21.44 29.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.206 -0.934 . . . . 0.0 110.075 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.998 HG21 HD11 ' A' ' 134' ' ' LEU . 33.2 mt -76.64 -13.98 14.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.316 -0.865 . . . . 0.0 109.553 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -105.39 -48.02 3.8 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.382 -0.824 . . . . 0.0 110.044 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.722 HG22 ' O ' ' A' ' 83' ' ' TYR . 7.6 t -114.48 -2.72 13.12 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.272 -0.892 . . . . 0.0 110.168 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.614 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -89.88 34.88 3.92 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.548 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 2.5 t 74.28 150.14 0.11 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.447 -1.031 . . . . 0.0 110.157 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -65.18 -7.93 14.92 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.354 -0.841 . . . . 0.0 110.598 -179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -72.1 -38.47 69.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.111 -0.993 . . . . 0.0 109.732 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.728 HG11 ' HB2' ' A' ' 84' ' ' LEU . 84.0 t -60.08 -28.92 42.52 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.372 -0.83 . . . . 0.0 109.937 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.517 ' CB ' HG23 ' A' ' 85' ' ' ILE . 10.3 p -83.57 -38.92 21.03 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.283 -0.886 . . . . 0.0 109.982 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -58.03 -57.89 10.83 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.228 -0.92 . . . . 0.0 109.694 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.552 ' OE1' ' CZ ' ' A' ' 53' ' ' PHE . 34.8 tt0 -52.79 -35.7 57.09 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.454 -0.778 . . . . 0.0 109.448 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.416 ' SG ' HD11 ' A' ' 85' ' ' ILE . 1.7 t -55.41 -44.23 76.01 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 109.563 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -66.0 -46.81 76.65 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.497 -0.752 . . . . 0.0 109.747 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -65.01 -16.12 63.08 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.408 -0.807 . . . . 0.0 109.797 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.5 32.81 4.95 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.366 -0.834 . . . . 0.0 109.844 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.1 mtp -61.63 -28.26 69.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.298 -0.876 . . . . 0.0 110.224 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.476 ' O ' ' HB ' ' A' ' 105' ' ' THR . 15.6 m-85 -66.84 -24.97 66.21 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.236 -0.915 . . . . 0.0 109.934 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.951 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.59 -40.88 48.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.885 . . . . 0.0 110.008 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.538 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.9 t -75.06 -27.04 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.351 -0.843 . . . . 0.0 109.903 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.545 ' HG3' HG21 ' A' ' 131' ' ' VAL . 21.2 mt-30 -85.7 -28.24 24.79 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.411 -0.806 . . . . 0.0 109.985 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.4 t -53.44 -24.79 13.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.903 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 1.04 HD11 HD22 ' A' ' 64' ' ' LEU . 42.0 mt -70.53 -38.48 74.25 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.392 -0.818 . . . . 0.0 109.955 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.578 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 14.4 ttpt -55.6 -24.81 35.1 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.245 -0.909 . . . . 0.0 109.888 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.411 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 0.9 OUTLIER -106.16 -18.99 13.85 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.29 -0.881 . . . . 0.0 110.131 179.899 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.482 ' CZ ' ' HB3' ' A' ' 67' ' ' HIS . 5.4 t80 -60.01 95.43 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.231 -0.918 . . . . 0.0 110.099 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 2.8 mt-30 -119.5 146.63 45.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.327 -0.858 . . . . 0.0 110.164 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -166.73 100.49 0.57 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.205 -0.935 . . . . 0.0 110.218 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.597 ' O ' HG13 ' A' ' 112' ' ' VAL . 3.4 p -124.85 35.23 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.219 -0.926 . . . . 0.0 110.328 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.462 ' CB ' ' O ' ' A' ' 112' ' ' VAL . 0.4 OUTLIER 67.59 -174.86 0.19 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.166 -0.959 . . . . 0.0 110.231 179.937 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.58 -48.47 63.15 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.202 -0.936 . . . . 0.0 110.306 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -149.77 137.71 20.3 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.241 -0.912 . . . . 0.0 110.257 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 177.43 -154.28 15.23 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 118' ' ' ASP . 0.8 OUTLIER -121.17 109.36 14.9 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.328 -1.101 . . . . 0.0 110.082 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.411 ' C ' ' O ' ' A' ' 117' ' ' LYS . 11.9 t0 -43.59 99.63 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.262 -0.899 . . . . 0.0 110.27 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.41 ' N ' ' O ' ' A' ' 117' ' ' LYS . 0.1 OUTLIER -100.36 -9.57 22.12 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.219 -0.925 . . . . 0.0 110.4 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -88.92 57.08 4.06 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.555 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.1 p -90.59 -44.34 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.273 -1.134 . . . . 0.0 110.353 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.555 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.2 m-80 -40.91 -46.94 2.89 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.482 -0.761 . . . . 0.0 110.271 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.715 HG22 ' HE1' ' A' ' 78' ' ' MET . 0.9 OUTLIER -66.33 -42.92 91.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.319 -0.863 . . . . 0.0 109.867 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.578 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -56.87 -67.85 0.27 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.188 -0.945 . . . . 0.0 111.063 -179.554 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.18 -35.95 76.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.284 -0.885 . . . . 0.0 111.331 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 0.0 OUTLIER -57.56 -54.14 50.2 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.111 -0.993 . . . . 0.0 110.446 -179.561 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.538 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -57.25 -40.8 78.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.38 -0.825 . . . . 0.0 110.068 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt -62.5 -33.72 75.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.183 -0.948 . . . . 0.0 110.241 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -62.71 -40.27 96.63 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.287 -0.883 . . . . 0.0 110.586 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.903 HD21 ' CD1' ' A' ' 85' ' ' ILE . 0.6 OUTLIER -62.5 -53.05 60.44 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.248 -0.907 . . . . 0.0 110.569 -179.677 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.545 HG21 ' HG3' ' A' ' 104' ' ' GLN . 25.3 t -65.84 -25.68 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.408 -0.807 . . . . 0.0 110.413 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 135' ' ' ARG . . . -65.92 -55.55 16.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.25 -0.906 . . . . 0.0 110.509 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.85 -56.94 15.17 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.137 -0.977 . . . . 0.0 110.307 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.998 HD11 HG21 ' A' ' 85' ' ' ILE . 3.0 mp -46.34 -52.37 12.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.23 -0.919 . . . . 0.0 110.136 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 132' ' ' ALA . 4.4 tpt180 -99.87 117.38 34.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.245 -0.91 . . . . 0.0 110.075 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -146.16 -38.32 0.24 Allowed 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.203 -0.935 . . . . 0.0 110.43 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -109.44 166.93 10.5 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.152 -0.968 . . . . 0.0 110.265 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.64 125.65 12.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.314 -0.866 . . . . 0.0 110.291 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -68.14 0.19 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 0.0 110.219 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.73 178.23 0.12 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.276 -0.89 . . . . 0.0 110.251 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -120.94 -18.32 7.6 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.25 -0.906 . . . . 0.0 110.139 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -103.17 -164.75 1.1 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.272 -0.892 . . . . 0.0 110.262 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -164.57 41.21 0.08 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 40.0 mtt180 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.207 179.992 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.76 -17.33 24.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.328 -1.101 . . . . 0.0 110.15 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 59.8 p -61.15 -158.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.21 -0.932 . . . . 0.0 110.16 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 0' ' ' ARG . . . . . 0.616 ' O ' HG23 ' A' ' 3' ' ' THR . 40.2 mtm-85 -100.99 15.93 27.04 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.234 -0.916 . . . . 0.0 110.208 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.401 ' O ' ' C ' ' A' ' 2' ' ' SER . 32.3 mmm 50.91 30.14 4.99 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.181 -0.949 . . . . 0.0 110.266 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.401 ' C ' ' O ' ' A' ' 1' ' ' MET . 41.8 t 44.71 61.49 2.44 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.182 -0.949 . . . . 0.0 110.217 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.616 HG23 ' O ' ' A' ' 0' ' ' ARG . 47.0 p -56.45 -27.3 56.41 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.212 -0.93 . . . . 0.0 110.268 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 54.96 40.41 32.0 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.266 -0.896 . . . . 0.0 110.198 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.9 t 52.63 -171.49 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.262 -0.899 . . . . 0.0 110.254 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.98 128.36 15.9 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.175 -0.953 . . . . 0.0 110.232 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -80.16 152.57 29.14 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.28 -0.887 . . . . 0.0 110.24 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.418 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -117.38 149.53 40.37 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.235 -0.915 . . . . 0.0 110.266 -179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -149.87 132.78 16.1 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.224 -0.922 . . . . 0.0 110.211 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.8 mtt -132.41 -145.76 0.27 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.292 -0.88 . . . . 0.0 110.261 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.7 mtmp? -75.06 -56.91 4.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 110.295 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.1 m120 49.06 32.83 4.22 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.213 -0.929 . . . . 0.0 110.181 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 tt -98.16 -23.66 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.273 -0.892 . . . . 0.0 110.184 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.3 t -70.63 94.59 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.26 -0.9 . . . . 0.0 110.155 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -94.15 92.26 7.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.282 -0.887 . . . . 0.0 110.259 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -130.8 16.81 5.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.231 -0.918 . . . . 0.0 110.176 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.514 ' O ' ' CD1' ' A' ' 17' ' ' TYR . 41.1 p90 -80.63 136.25 36.19 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.889 . . . . 0.0 110.184 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.45 ' O ' ' HB3' ' A' ' 19' ' ' GLU . 30.7 t -111.17 -45.48 3.42 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.29 -0.881 . . . . 0.0 110.125 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 1.002 ' HB2' HD12 ' A' ' 22' ' ' ILE . 0.1 OUTLIER 175.26 48.69 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.25 -0.906 . . . . 0.0 110.23 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.987 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -64.89 -56.8 11.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 110.216 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' A' ' 20' ' ' ALA . 18.8 pt-20 -42.96 -28.52 0.26 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.255 -0.903 . . . . 0.0 110.039 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 1.002 HD12 ' HB2' ' A' ' 19' ' ' GLU . 40.8 mt -74.19 -57.65 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.314 -0.866 . . . . 0.0 110.037 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.491 ' CB ' HG12 ' A' ' 43' ' ' ILE . 1.8 mmpt? -48.09 -51.05 26.14 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.351 -0.843 . . . . 0.0 110.214 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.943 HG13 ' CD2' ' A' ' 80' ' ' LEU . 20.0 t -56.28 -36.28 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.286 -0.884 . . . . 0.0 110.207 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.4 ttt85 -67.05 -38.14 85.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.2 -0.937 . . . . 0.0 110.177 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -81.18 -14.75 57.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.265 -0.897 . . . . 0.0 109.966 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.811 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -77.72 -20.29 53.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.867 . . . . 0.0 110.244 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.467 HG22 ' HB3' ' A' ' 76' ' ' LYS . 30.2 p -126.01 61.9 1.26 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.226 -0.921 . . . . 0.0 110.251 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.47 ' O ' ' OG ' ' A' ' 29' ' ' SER . 3.2 p -179.6 106.42 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 0.0 110.17 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -83.99 0.65 47.17 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.256 -0.902 . . . . 0.0 110.241 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.569 ' CB ' ' CD ' ' A' ' 32' ' ' PRO . 0.5 OUTLIER -52.95 -60.12 7.4 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.315 -0.866 . . . . 0.0 110.289 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.569 ' CD ' ' CB ' ' A' ' 31' ' ' ASP . 19.5 Cg_endo -64.57 -176.54 0.43 Allowed 'Trans proline' 0 C--N 1.306 -1.706 0 O-C-N 123.947 1.499 . . . . 0.0 110.321 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.406 ' C ' ' O ' ' A' ' 32' ' ' PRO . 1.0 OUTLIER -43.09 -87.15 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.276 -0.89 . . . . 0.0 110.644 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 175.06 -167.69 39.91 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -57.98 150.79 61.95 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 O-C-N 124.054 1.555 . . . . 0.0 110.498 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.2 m -142.61 125.32 15.93 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.265 -0.897 . . . . 0.0 110.13 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.4 t 48.98 48.42 20.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.282 -0.886 . . . . 0.0 110.199 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 t 58.06 100.73 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.299 -0.875 . . . . 0.0 110.149 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.811 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.6 OUTLIER -89.2 -9.55 50.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.345 -0.847 . . . . 0.0 110.263 -179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.573 ' CE ' HG22 ' A' ' 79' ' ' THR . 6.9 mmm -84.79 -45.79 12.01 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.186 -0.946 . . . . 0.0 110.207 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.408 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.2 OUTLIER -63.97 -29.34 70.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.355 -0.84 . . . . 0.0 110.277 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -72.77 -49.64 29.55 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.938 . . . . 0.0 110.102 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.799 HG21 HD11 ' A' ' 80' ' ' LEU . 44.7 mt -55.91 -33.87 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.273 -0.892 . . . . 0.0 110.022 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.64 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -71.63 -52.9 15.56 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.236 -0.915 . . . . 0.0 109.401 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.478 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 7.4 t70 -51.82 -22.38 3.63 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.059 -1.025 . . . . 0.0 108.742 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.987 HD22 ' HB2' ' A' ' 20' ' ' ALA . 8.1 mt -78.24 -40.03 38.47 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.611 -0.681 . . . . 0.0 110.017 179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.525 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 73.1 p -49.69 -42.0 44.64 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.11 -0.994 . . . . 0.0 109.159 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.561 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 83.7 m-85 -45.52 -46.27 13.85 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.234 -0.916 . . . . 0.0 109.367 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 50' ' ' VAL . 22.7 m-20 -71.14 89.65 0.85 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.529 -0.732 . . . . 0.0 110.358 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.73 -57.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.561 178.228 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.54 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -63.07 -65.9 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.04 -1.037 . . . . 0.0 110.069 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -38.16 -42.43 0.67 Allowed 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.305 0.574 . . . . 0.0 110.602 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.525 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 10.0 t80 -59.56 -53.65 55.67 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.376 -0.828 . . . . 0.0 109.952 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -30.36 62.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.28 -0.887 . . . . 0.0 109.745 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.68 -25.67 41.18 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.307 -0.871 . . . . 0.0 110.178 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.863 ' HA ' HG21 ' A' ' 24' ' ' VAL . 6.9 mt -77.59 -70.18 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.324 -0.86 . . . . 0.0 110.283 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.497 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 91.6 mmm -47.75 -36.31 11.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.21 -0.931 . . . . 0.0 109.91 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 t -55.21 -60.67 3.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.377 -0.827 . . . . 0.0 109.971 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.27 -25.6 65.83 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -0.953 . . . . 0.0 109.687 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.647 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -71.1 -29.59 37.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.379 -0.825 . . . . 0.0 109.506 179.641 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.477 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 13.4 m95 -78.21 -41.04 35.69 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.239 -0.913 . . . . 0.0 109.964 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.78 -53.03 53.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.329 -0.857 . . . . 0.0 109.964 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.488 ' HB3' ' HB3' ' A' ' 73' ' ' HIS . 4.0 mmt180 -70.06 -33.83 72.43 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.381 -0.824 . . . . 0.0 109.992 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.941 HD22 HD11 ' A' ' 106' ' ' LEU . 11.8 mt -65.11 -9.45 22.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.447 -0.783 . . . . 0.0 110.357 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.451 ' O ' ' C ' ' A' ' 66' ' ' ASP . 1.4 m-20 -87.83 31.51 0.77 Allowed 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.307 -0.87 . . . . 0.0 110.156 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.579 ' HB2' ' CZ ' ' A' ' 109' ' ' PHE . 4.4 p30 37.28 -158.36 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 121.805 0.812 . . . . 0.0 110.801 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.422 ' CB ' ' O ' ' A' ' 66' ' ' ASP . 0.1 OUTLIER 172.92 -155.41 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.636 -0.665 . . . . 0.0 109.977 -179.814 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -66.53 -100.68 0.02 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.17 43.31 1.29 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.256 -1.144 . . . . 0.0 110.288 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -129.71 41.81 3.38 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.325 -0.859 . . . . 0.0 110.409 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.455 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 35.7 p-90 -62.62 -13.24 29.41 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.198 -0.939 . . . . 0.0 110.048 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -52.56 -39.59 61.66 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.392 -0.817 . . . . 0.0 110.287 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.488 ' HB3' ' HB3' ' A' ' 63' ' ' ARG . 5.0 m-70 -61.99 -36.81 82.6 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.207 -0.933 . . . . 0.0 110.111 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.813 HG12 HG22 ' A' ' 123' ' ' VAL . 24.5 t -59.06 -54.54 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.31 -0.869 . . . . 0.0 110.125 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.461 ' HA ' ' HE1' ' A' ' 78' ' ' MET . 22.7 t80 -49.91 -56.45 10.5 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.183 -0.948 . . . . 0.0 109.995 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.467 ' HB3' HG22 ' A' ' 28' ' ' THR . 0.0 OUTLIER -59.74 -25.81 65.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.352 -0.843 . . . . 0.0 110.036 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.793 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -73.12 -27.43 61.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.317 -0.864 . . . . 0.0 110.038 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.643 ' SD ' HD13 ' A' ' 106' ' ' LEU . 1.5 mpp? -74.76 -32.96 62.21 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.327 -0.858 . . . . 0.0 109.991 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.573 HG22 ' CE ' ' A' ' 40' ' ' MET . 35.9 m -74.69 -27.74 60.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.399 -0.813 . . . . 0.0 110.283 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.943 ' CD2' HG13 ' A' ' 24' ' ' VAL . 19.5 tp -76.09 -53.49 8.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.161 -0.962 . . . . 0.0 109.378 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.808 ' HE2' HD11 ' A' ' 64' ' ' LEU . 6.5 ttp -61.39 -20.62 63.24 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.158 -0.964 . . . . 0.0 109.724 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.576 ' CB ' HD13 ' A' ' 130' ' ' LEU . 13.4 tm-20 -88.36 -33.49 17.93 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.167 -0.958 . . . . 0.0 110.354 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.49 ' O ' HG22 ' A' ' 87' ' ' THR . 10.5 t80 -79.87 -21.92 43.48 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.269 -0.894 . . . . 0.0 110.467 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.581 HD13 HG21 ' A' ' 56' ' ' ILE . 68.5 mt -88.86 -34.74 16.89 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.261 -0.899 . . . . 0.0 110.021 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.813 HD12 HD11 ' A' ' 130' ' ' LEU . 37.5 mt -56.95 -22.95 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.061 -1.024 . . . . 0.0 109.972 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -95.24 -80.49 0.41 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.233 -0.917 . . . . 0.0 110.284 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.64 HG23 ' HB1' ' A' ' 44' ' ' ALA . 7.9 t -75.65 -24.44 56.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.254 -0.904 . . . . 0.0 110.319 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.561 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -49.34 -77.29 0.13 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.0 t 177.09 154.16 0.24 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.251 -1.146 . . . . 0.0 110.31 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.47 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 1.6 mt-10 -55.92 -17.19 5.91 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.902 . . . . 0.0 110.303 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -77.02 -38.02 53.81 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.181 -0.949 . . . . 0.0 110.11 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.486 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 73.1 t -59.67 -38.96 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.213 -0.929 . . . . 0.0 110.084 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.91 -40.24 72.28 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.881 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 90' ' ' GLU . 5.6 mt-30 -60.72 -39.77 89.81 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.229 -0.919 . . . . 0.0 109.994 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.441 ' HA ' ' OE1' ' A' ' 95' ' ' GLN . 3.5 tp60 -65.07 -39.59 93.46 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.321 -0.862 . . . . 0.0 109.259 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.814 ' HB3' HD13 ' A' ' 134' ' ' LEU . 2.8 m -56.2 -41.31 75.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.341 -0.849 . . . . 0.0 109.503 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 22.0 mtmt -67.56 -32.46 73.25 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.497 -0.752 . . . . 0.0 109.441 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -80.31 -14.32 58.47 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.411 -0.805 . . . . 0.0 109.68 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -129.86 33.4 4.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.452 -0.78 . . . . 0.0 110.08 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.459 ' HE3' ' CZ ' ' A' ' 101' ' ' TYR . 8.4 ptt? -60.74 -28.94 69.07 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.247 -0.908 . . . . 0.0 110.252 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.459 ' CZ ' ' HE3' ' A' ' 100' ' ' MET . 41.5 m-85 -65.61 -26.4 67.81 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.337 -0.852 . . . . 0.0 110.198 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.969 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.65 -41.4 45.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 110.133 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.429 HG23 ' H ' ' A' ' 103' ' ' VAL . 2.5 t -73.2 -25.85 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.324 -0.86 . . . . 0.0 109.989 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -87.65 -24.82 23.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.287 -0.883 . . . . 0.0 110.452 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.969 HG22 ' O ' ' A' ' 102' ' ' ALA . 12.0 t -63.59 -12.61 34.57 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.186 -0.946 . . . . 0.0 110.368 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.941 HD11 HD22 ' A' ' 64' ' ' LEU . 17.4 mt -73.86 -40.05 63.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.189 -0.944 . . . . 0.0 110.219 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.473 ' HG3' ' N ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -49.17 -24.84 1.86 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.161 -0.962 . . . . 0.0 110.025 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.473 ' N ' ' HG3' ' A' ' 107' ' ' LYS . 10.8 t0 -93.72 -31.44 14.43 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.269 -0.894 . . . . 0.0 110.249 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.579 ' CZ ' ' HB2' ' A' ' 66' ' ' ASP . 1.3 t80 -49.09 115.13 1.18 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.188 -0.945 . . . . 0.0 110.223 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.471 ' CG ' ' O ' ' A' ' 110' ' ' GLN . 2.4 pt20 -154.1 120.13 5.33 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.325 -0.859 . . . . 0.0 109.902 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.493 ' CD1' ' C ' ' A' ' 111' ' ' TYR . 1.5 t80 -168.52 113.21 0.61 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.253 -0.904 . . . . 0.0 110.263 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.659 HG12 ' N ' ' A' ' 113' ' ' ASP . 73.7 t -88.29 -100.61 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.26 -0.9 . . . . 0.0 110.019 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.659 ' N ' HG12 ' A' ' 112' ' ' VAL . 0.2 OUTLIER -153.78 -165.92 2.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.081 -1.012 . . . . 0.0 110.106 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 18.7 ptt-85 -46.47 -46.48 18.98 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.262 -0.898 . . . . 0.0 109.888 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -154.94 40.69 0.44 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.463 -0.773 . . . . 0.0 110.049 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.521 ' C ' HG11 ' A' ' 112' ' ' VAL . . . -81.53 -158.55 21.57 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.496 ' N ' HG11 ' A' ' 112' ' ' VAL . 73.8 tttt -122.91 138.26 54.72 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.321 -1.106 . . . . 0.0 110.297 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.518 ' HA ' ' CG2' ' A' ' 112' ' ' VAL . 6.0 t0 -47.55 112.94 0.61 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.315 -0.866 . . . . 0.0 110.072 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -143.12 39.29 1.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.243 -0.91 . . . . 0.0 110.346 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -127.53 38.98 2.01 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.561 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.9 p -82.51 -43.64 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.222 -1.164 . . . . 0.0 110.26 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.561 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 2.6 t30 -40.56 -27.68 0.05 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.595 -0.69 . . . . 0.0 110.257 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.813 HG22 HG12 ' A' ' 74' ' ' VAL . 2.0 t -76.74 -49.23 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.245 -0.909 . . . . 0.0 109.968 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -60.34 -36.8 78.81 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.116 -0.99 . . . . 0.0 110.802 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -77.93 -61.41 2.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.183 -0.948 . . . . 0.0 110.88 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -48.65 -44.52 37.62 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.151 -0.968 . . . . 0.0 110.268 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.504 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -65.38 -44.14 88.49 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.298 -0.876 . . . . 0.0 110.411 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -49.79 -39.13 37.12 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.186 -0.946 . . . . 0.0 110.505 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -71.31 -50.95 27.31 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.221 -0.924 . . . . 0.0 110.438 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.813 HD11 HD12 ' A' ' 85' ' ' ILE . 11.9 tp -49.48 -22.31 1.17 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.247 -0.908 . . . . 0.0 110.317 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 127' ' ' ALA . 42.8 t -92.19 -31.76 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 110.304 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.408 ' O ' ' C ' ' A' ' 133' ' ' LEU . . . -70.37 -63.13 1.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.318 -0.864 . . . . 0.0 110.302 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.408 ' C ' ' O ' ' A' ' 132' ' ' ALA . 13.2 tp -43.53 -27.42 0.29 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.228 -0.92 . . . . 0.0 110.351 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.814 HD13 ' HB3' ' A' ' 96' ' ' CYS . 20.5 mt -77.9 -57.5 3.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.914 . . . . 0.0 110.335 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -105.26 54.93 0.7 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.167 -0.958 . . . . 0.0 110.196 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -81.9 -67.7 0.76 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.342 -0.849 . . . . 0.0 110.292 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -100.0 168.8 9.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.221 -0.924 . . . . 0.0 110.292 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -143.52 164.44 30.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.14 -0.975 . . . . 0.0 110.328 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.407 ' O ' ' C ' ' A' ' 140' ' ' LEU . 10.0 mtm180 -51.95 -84.14 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.27 -0.894 . . . . 0.0 110.324 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 139' ' ' ARG . 0.9 OUTLIER 43.58 78.07 0.06 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.194 -0.941 . . . . 0.0 110.162 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -56.61 143.97 33.81 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.294 -0.879 . . . . 0.0 110.433 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.454 ' CG ' ' O ' ' A' ' 142' ' ' GLU . 0.1 OUTLIER -79.34 95.51 5.73 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.377 -0.827 . . . . 0.0 110.078 179.879 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -51.33 116.83 2.24 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.283 -0.885 . . . . 0.0 110.261 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.193 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -136.07 127.9 29.26 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.337 -1.096 . . . . 0.0 110.095 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.71 76.92 0.45 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 110.211 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -115.31 -177.71 3.2 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.257 -0.902 . . . . 0.0 110.196 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -103.89 -5.1 22.65 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.278 -0.889 . . . . 0.0 110.167 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.46 138.52 3.02 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.169 -0.957 . . . . 0.0 110.252 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.4 p -117.78 9.99 13.15 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.295 -0.878 . . . . 0.0 110.264 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.03 39.13 3.6 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.208 -0.932 . . . . 0.0 110.228 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -172.11 2.08 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.292 -0.88 . . . . 0.0 110.224 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.44 170.65 8.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.258 -0.901 . . . . 0.0 110.102 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.4 mtt85 -118.31 7.95 12.13 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.217 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.5 mmt-85 -59.18 143.1 49.92 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.361 -0.837 . . . . 0.0 110.258 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -139.73 80.14 1.75 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.254 -0.904 . . . . 0.0 110.186 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -97.59 -28.38 13.96 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.16 153.85 6.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.221 -0.925 . . . . 0.0 110.252 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.439 ' O ' ' HB ' ' A' ' 13' ' ' ILE . 18.0 p-10 -149.47 55.78 0.97 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.404 -0.81 . . . . 0.0 110.134 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.439 ' HB ' ' O ' ' A' ' 12' ' ' ASN . 19.5 mt 60.5 164.74 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.237 -0.914 . . . . 0.0 110.168 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.9 m -139.12 114.9 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.263 -0.898 . . . . 0.0 110.287 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.61 -155.31 0.49 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 110.341 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.473 ' OD1' HG21 ' A' ' 51' ' ' VAL . 34.6 t-20 -70.04 -32.6 70.8 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.297 -0.877 . . . . 0.0 110.329 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -74.28 140.14 44.74 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.219 -0.926 . . . . 0.0 110.286 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -117.57 7.38 12.64 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.211 -0.93 . . . . 0.0 110.14 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.451 ' O ' ' HB ' ' A' ' 22' ' ' ILE . 4.5 mt-10 54.52 21.65 3.47 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.294 -0.879 . . . . 0.0 110.344 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.851 ' HB2' HD13 ' A' ' 46' ' ' LEU . . . -57.19 -50.45 72.8 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.918 . . . . 0.0 110.095 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 1.2 pt-20 -48.52 -28.06 3.12 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.203 -0.936 . . . . 0.0 109.897 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.451 ' HB ' ' O ' ' A' ' 19' ' ' GLU . 49.3 mm -73.29 -41.47 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.295 -0.878 . . . . 0.0 109.904 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.473 ' CB ' HG12 ' A' ' 43' ' ' ILE . 11.6 mmtt -64.56 -42.75 95.47 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.253 -0.904 . . . . 0.0 109.907 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 1.036 HG22 HD21 ' A' ' 80' ' ' LEU . 14.8 t -64.81 -30.65 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.264 -0.897 . . . . 0.0 110.03 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -62.34 -42.69 99.59 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.201 -0.937 . . . . 0.0 110.04 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -83.44 -19.88 35.12 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.48 -0.763 . . . . 0.0 110.108 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.872 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -81.25 -14.16 57.74 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.307 -0.87 . . . . 0.0 110.25 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.492 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 3.8 p -103.09 7.36 38.86 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.24 -0.912 . . . . 0.0 110.292 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 36.1 t -85.78 -80.7 0.22 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.141 -0.974 . . . . 0.0 110.198 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.417 ' O ' ' CB ' ' A' ' 31' ' ' ASP . 10.5 t30 178.73 -58.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.302 -0.873 . . . . 0.0 109.976 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.417 ' CB ' ' O ' ' A' ' 30' ' ' ASN . 0.1 OUTLIER 64.23 89.23 0.11 Allowed Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.346 -0.846 . . . . 0.0 110.332 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 31' ' ' ASP . 13.4 Cg_endo -61.86 -168.28 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.035 1.545 . . . . 0.0 110.167 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.407 ' O ' ' O ' ' A' ' 34' ' ' GLY . 0.5 OUTLIER 57.52 173.04 0.05 OUTLIER 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.268 -0.895 . . . . 0.0 110.473 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.407 ' O ' ' O ' ' A' ' 33' ' ' TRP . . . -58.09 -164.23 0.07 OUTLIER Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.423 ' O ' ' O ' ' A' ' 36' ' ' SER . 18.4 Cg_endo -65.06 -76.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.77 0 O-C-N 123.985 1.519 . . . . 0.0 110.292 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 35' ' ' PRO . 1.3 m 61.57 136.05 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.31 -0.869 . . . . 0.0 110.238 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 63.28 167.69 0.14 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.906 . . . . 0.0 110.239 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.9 t -129.1 101.58 6.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.312 -0.868 . . . . 0.0 110.039 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.872 HD21 ' HB2' ' A' ' 27' ' ' ALA . 1.9 tp -109.72 -45.76 3.61 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.282 -0.886 . . . . 0.0 110.369 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -44.45 77.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.266 -0.896 . . . . 0.0 110.497 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.411 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.1 OUTLIER -66.5 -28.25 68.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.171 -0.956 . . . . 0.0 110.589 -179.767 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.68 -47.73 44.97 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.203 -0.936 . . . . 0.0 110.257 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.648 HG23 HG12 ' A' ' 56' ' ' ILE . 62.6 mt -57.25 -36.09 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.177 -0.952 . . . . 0.0 110.029 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.725 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.33 -49.84 45.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.174 -0.954 . . . . 0.0 109.522 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -51.25 -22.27 2.61 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.029 -1.044 . . . . 0.0 108.831 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.851 HD13 ' HB2' ' A' ' 20' ' ' ALA . 12.4 mt -81.99 -37.99 25.79 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.623 -0.673 . . . . 0.0 110.245 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.573 HG21 HG21 ' A' ' 92' ' ' VAL . 71.8 p -50.51 -40.53 51.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.111 -0.993 . . . . 0.0 109.474 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 49' ' ' ASN . 66.9 m-85 -44.61 -46.75 10.23 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 119.624 -0.83 . . . . 0.0 109.122 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.473 ' O ' ' O ' ' A' ' 48' ' ' TYR . 0.8 OUTLIER -55.62 -158.76 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 CA-C-O 121.98 0.895 . . . . 0.0 110.498 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.428 ' CG2' ' N ' ' A' ' 51' ' ' VAL . 3.1 m -125.5 -34.67 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -178.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.541 HG12 ' N ' ' A' ' 52' ' ' ALA . 8.5 t -82.88 -70.64 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 CA-C-O 122.07 0.938 . . . . 0.0 109.618 178.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.665 ' HB1' ' HB2' ' A' ' 20' ' ' ALA . . . -40.37 -41.58 1.4 Allowed 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.247 -178.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.543 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 12.6 t80 -56.2 -52.6 63.84 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.471 -0.768 . . . . 0.0 109.861 179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 58' ' ' SER . 40.9 t -60.49 -26.86 67.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.316 -0.865 . . . . 0.0 109.643 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 1.7 mm-40 -81.45 -21.56 38.74 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.47 -0.769 . . . . 0.0 109.782 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.648 HG12 HG23 ' A' ' 43' ' ' ILE . 7.7 mt -81.78 -70.12 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.328 -0.857 . . . . 0.0 109.851 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.418 ' HA ' ' HB ' ' A' ' 60' ' ' ILE . 79.8 mmm -49.73 -36.68 26.42 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.31 -0.869 . . . . 0.0 109.73 179.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 54' ' ' SER . 2.2 m -55.83 -60.41 3.5 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.316 -0.865 . . . . 0.0 109.696 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.406 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.5 OUTLIER -59.38 -23.84 62.93 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.253 -0.904 . . . . 0.0 109.674 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.547 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -71.64 -33.14 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.427 -0.796 . . . . 0.0 109.569 179.776 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.422 ' CH2' ' CE ' ' A' ' 81' ' ' MET . 28.2 m95 -77.91 -31.35 51.12 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.212 -0.93 . . . . 0.0 109.998 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.93 -57.51 7.69 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.271 -0.893 . . . . 0.0 110.108 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.403 ' NH1' ' CE1' ' A' ' 73' ' ' HIS . 13.7 mmt180 -66.42 -9.89 38.43 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.191 -0.943 . . . . 0.0 109.906 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.984 HD22 HD11 ' A' ' 106' ' ' LEU . 6.2 mt -84.83 -17.65 37.4 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.343 -0.848 . . . . 0.0 110.325 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.472 ' O ' ' O ' ' A' ' 66' ' ' ASP . 25.0 m-20 -110.55 43.05 1.46 Allowed 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.238 -0.914 . . . . 0.0 109.904 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.527 ' OD1' ' CE2' ' A' ' 109' ' ' PHE . 5.5 p-10 -52.73 -167.88 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.453 -0.779 . . . . 0.0 110.408 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.75 -175.49 4.46 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.294 -0.878 . . . . 0.0 110.257 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 49.46 -112.6 1.41 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.456 ' CG ' ' O ' ' A' ' 69' ' ' LYS . 1.0 OUTLIER -130.62 57.87 1.71 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.284 -1.127 . . . . 0.0 110.134 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -131.12 32.32 4.3 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.207 -0.933 . . . . 0.0 110.49 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.423 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . 70.0 p-90 -57.13 -18.14 13.76 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.14 -0.975 . . . . 0.0 110.142 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 13.2 mtp180 -52.63 -41.89 64.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.22 -0.925 . . . . 0.0 110.234 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.403 ' CE1' ' NH1' ' A' ' 63' ' ' ARG . 10.0 m170 -60.62 -41.59 95.17 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.192 -0.943 . . . . 0.0 110.085 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.629 HG11 ' CG1' ' A' ' 123' ' ' VAL . 24.7 t -56.05 -50.8 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.289 -0.882 . . . . 0.0 110.022 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.558 ' CE1' ' O ' ' A' ' 122' ' ' ASN . 7.4 t80 -49.47 -56.7 8.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.207 -0.933 . . . . 0.0 110.226 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -59.19 -26.93 65.24 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.196 -0.94 . . . . 0.0 109.951 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.776 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -70.15 -28.68 65.54 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 110.182 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.694 ' SD ' HD21 ' A' ' 64' ' ' LEU . 1.6 mpp? -76.43 -32.08 58.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.405 -0.809 . . . . 0.0 110.229 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 9.9 m -66.9 -40.18 87.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.082 -1.011 . . . . 0.0 110.122 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 1.036 HD21 HG22 ' A' ' 24' ' ' VAL . 16.2 tp -64.94 -54.14 35.42 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.333 -0.854 . . . . 0.0 109.783 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.529 ' HE2' HG22 ' A' ' 103' ' ' VAL . 0.2 OUTLIER -59.19 -25.27 63.81 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.868 . . . . 0.0 109.887 179.561 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.579 ' HB2' HD12 ' A' ' 130' ' ' LEU . 0.9 OUTLIER -78.46 -34.13 47.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.252 -0.905 . . . . 0.0 110.385 179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.578 ' O ' HG22 ' A' ' 87' ' ' THR . 26.0 t80 -85.6 -16.61 38.72 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.262 -0.899 . . . . 0.0 110.714 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.725 HD23 ' HB2' ' A' ' 44' ' ' ALA . 85.1 mt -92.54 -38.98 11.62 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.166 -0.959 . . . . 0.0 110.232 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.856 HD13 HD11 ' A' ' 134' ' ' LEU . 52.0 mt -57.1 -17.19 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.115 -0.991 . . . . 0.0 109.807 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.58 -80.54 0.47 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.294 -0.879 . . . . 0.0 110.191 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.578 HG22 ' O ' ' A' ' 83' ' ' TYR . 15.0 t -77.72 -18.77 56.22 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.201 -0.937 . . . . 0.0 110.142 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.479 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -55.99 -74.35 0.33 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.212 -1.555 . . . . 0.0 109.212 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 174.47 152.43 0.11 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -1.12 . . . . 0.0 110.337 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -51.98 -24.43 6.53 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 110.109 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.517 ' O ' ' HG2' ' A' ' 94' ' ' GLN . 40.4 mtt180 -70.26 -44.23 68.88 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.304 -0.873 . . . . 0.0 109.722 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 47' ' ' THR . 39.7 t -59.04 -22.16 21.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 120.874 -1.141 . . . . 0.0 108.995 179.21 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.703 ' HB2' HG23 ' A' ' 85' ' ' ILE . 1.9 t -95.18 -19.2 20.26 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.585 -0.697 . . . . 0.0 110.49 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.598 ' CG ' ' N ' ' A' ' 95' ' ' GLN . 7.2 pt20 -79.53 -48.2 14.26 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.93 -1.106 . . . . 0.0 109.104 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.598 ' N ' ' CG ' ' A' ' 94' ' ' GLN . 8.5 tt0 -63.12 -36.45 83.65 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 36.4 t -59.77 -36.27 76.32 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.344 -0.848 . . . . 0.0 109.403 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.18 -35.53 66.41 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.417 -0.802 . . . . 0.0 109.466 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -74.46 -18.29 60.65 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.481 -0.762 . . . . 0.0 109.652 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -121.97 36.8 4.53 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.511 -0.743 . . . . 0.0 109.988 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.845 ' SD ' HG13 ' A' ' 131' ' ' VAL . 2.0 tpp -59.57 -30.19 68.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.196 -0.94 . . . . 0.0 110.032 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.462 ' O ' ' HB ' ' A' ' 105' ' ' THR . 17.5 m-85 -62.03 -30.04 70.69 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.287 -0.883 . . . . 0.0 109.878 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.957 ' O ' HG22 ' A' ' 105' ' ' THR . . . -70.34 -40.18 74.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.341 -0.849 . . . . 0.0 110.13 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.529 HG22 ' HE2' ' A' ' 81' ' ' MET . 4.6 t -74.86 -27.84 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.354 -0.841 . . . . 0.0 110.332 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.513 ' O ' ' CG ' ' A' ' 107' ' ' LYS . 2.0 mm100 -88.63 -19.51 26.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.314 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.957 HG22 ' O ' ' A' ' 102' ' ' ALA . 11.0 t -67.14 -14.73 63.18 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.17 -0.956 . . . . 0.0 109.985 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.984 HD11 HD22 ' A' ' 64' ' ' LEU . 56.6 mt -77.01 -37.82 54.29 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.348 -0.845 . . . . 0.0 110.169 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.542 ' HA ' ' CB ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -53.93 -20.17 5.71 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.276 -0.89 . . . . 0.0 110.085 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.3 -30.0 17.76 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.308 -0.87 . . . . 0.0 110.322 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.527 ' CE2' ' OD1' ' A' ' 66' ' ' ASP . 0.1 OUTLIER -44.92 108.32 0.12 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.232 -0.917 . . . . 0.0 110.236 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 110' ' ' GLN . 4.2 pt20 -145.1 112.87 6.33 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.274 -0.892 . . . . 0.0 110.247 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.3 100.95 6.27 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.206 -0.934 . . . . 0.0 110.278 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.496 ' O ' HG13 ' A' ' 112' ' ' VAL . 3.1 p -138.0 27.49 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.208 -0.933 . . . . 0.0 110.365 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.32 -79.33 0.09 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.239 -0.913 . . . . 0.0 110.202 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -47.16 60.38 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.276 -0.89 . . . . 0.0 110.379 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.32 -89.33 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.234 -0.916 . . . . 0.0 110.14 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.46 ' CA ' HG22 ' A' ' 112' ' ' VAL . . . 120.7 11.02 6.71 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -122.85 97.53 5.49 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.223 -1.163 . . . . 0.0 110.261 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.82 114.14 1.0 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.301 -0.875 . . . . 0.0 110.114 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -147.06 26.08 1.1 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.164 -0.96 . . . . 0.0 110.2 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -116.22 43.6 1.63 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.609 HG22 ' HG3' ' A' ' 125' ' ' GLU . 3.4 p -93.12 -42.8 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.253 -1.145 . . . . 0.0 110.213 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.558 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 20.7 m-20 -37.16 -28.77 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.8 -0.562 . . . . 0.0 110.788 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.629 ' CG1' HG11 ' A' ' 74' ' ' VAL . 20.4 t -86.25 -63.06 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.247 -0.908 . . . . 0.0 110.303 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.542 ' CB ' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -41.96 -34.01 0.63 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.154 -0.966 . . . . 0.0 110.935 -179.578 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.609 ' HG3' HG22 ' A' ' 121' ' ' VAL . 3.2 mt-10 -82.18 -54.57 5.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.084 -1.01 . . . . 0.0 111.311 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.535 ' HB3' ' HE2' ' A' ' 78' ' ' MET . 0.0 OUTLIER -50.72 -50.14 56.07 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.969 -1.082 . . . . 0.0 110.338 -179.395 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.463 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -61.22 -42.87 99.36 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.38 -0.825 . . . . 0.0 110.408 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -55.51 -56.52 19.28 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.248 -0.907 . . . . 0.0 110.416 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -44.2 65.4 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.265 -0.897 . . . . 0.0 110.494 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.579 HD12 ' HB2' ' A' ' 82' ' ' GLU . 1.1 tt -56.04 -40.89 74.15 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.115 -0.991 . . . . 0.0 110.134 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.845 HG13 ' SD ' ' A' ' 100' ' ' MET . 38.6 t -68.13 -24.8 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.369 -0.832 . . . . 0.0 110.031 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -75.81 -51.66 12.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.351 -0.843 . . . . 0.0 110.385 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -35.13 21.52 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 0.0 110.667 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.856 HD11 HD13 ' A' ' 85' ' ' ILE . 0.9 OUTLIER -84.85 -40.83 16.65 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.425 -179.75 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -105.16 95.8 6.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.247 -0.908 . . . . 0.0 110.279 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -153.91 -77.61 0.11 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.301 -0.874 . . . . 0.0 110.337 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 138' ' ' ASP . 0.0 OUTLIER -172.25 -152.13 0.07 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.294 -0.879 . . . . 0.0 110.225 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.468 ' HB2' ' O ' ' A' ' 137' ' ' GLU . 22.0 m-20 57.17 157.19 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.43 -0.793 . . . . 0.0 110.361 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER 38.52 29.83 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.456 -0.778 . . . . 0.0 110.707 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.465 ' N ' ' O ' ' A' ' 138' ' ' ASP . 0.9 OUTLIER 43.56 -167.81 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.337 -0.852 . . . . 0.0 110.174 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -84.89 -16.28 41.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.2 -0.937 . . . . 0.0 110.265 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -151.96 -52.83 0.12 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.163 -0.961 . . . . 0.0 110.271 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.407 ' HB2' ' HB2' ' A' ' 140' ' ' LEU . 10.0 tt0 49.51 60.8 3.52 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.225 -0.922 . . . . 0.0 110.182 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 144' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.218 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -2' ' ' SER . . . . . 0.421 ' O ' ' OG ' ' A' ' -2' ' ' SER . 0.3 OUTLIER 61.05 29.04 18.72 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.221 -1.164 . . . . 0.0 110.224 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.06 79.48 3.58 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.176 -0.952 . . . . 0.0 110.177 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.02 92.58 0.95 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.276 -0.89 . . . . 0.0 110.247 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 ttt -86.17 135.44 33.58 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.218 -0.926 . . . . 0.0 110.251 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.63 159.1 42.95 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.307 -0.871 . . . . 0.0 110.156 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.2 p -104.82 68.66 0.84 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.195 -0.941 . . . . 0.0 110.18 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.402 ' O ' ' C ' ' A' ' 5' ' ' SER . 0.1 OUTLIER -174.23 29.78 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.372 -0.83 . . . . 0.0 110.17 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 6' ' ' LEU . 9.9 m -44.56 157.24 0.07 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.167 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.42 ' HA ' HD12 ' A' ' 6' ' ' LEU . 5.7 tp 62.91 112.91 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.278 -0.889 . . . . 0.0 110.205 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.24 -154.21 0.54 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.185 -0.947 . . . . 0.0 110.17 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.8 ptt-85 -87.78 -167.08 1.76 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.221 -0.925 . . . . 0.0 110.215 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.65 134.6 50.15 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.301 -0.874 . . . . 0.0 110.17 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 21.6 mtp -105.88 -179.76 4.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.249 -0.907 . . . . 0.0 110.184 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mmtt -62.78 -14.76 48.91 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.903 . . . . 0.0 110.051 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.14 132.2 51.66 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.26 -0.9 . . . . 0.0 110.188 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.9 mt -71.37 130.14 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.283 -0.885 . . . . 0.0 110.162 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.453 HG12 ' H ' ' A' ' 15' ' ' HIS . 4.8 t -95.66 173.62 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.277 -0.89 . . . . 0.0 110.228 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.453 ' H ' HG12 ' A' ' 14' ' ' VAL . 13.2 m170 -68.69 109.31 3.75 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.225 -0.922 . . . . 0.0 110.407 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -107.93 115.52 30.28 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.328 -0.857 . . . . 0.0 110.163 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -70.52 149.01 47.59 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.26 -0.9 . . . . 0.0 110.343 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.82 -14.79 43.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.209 -0.932 . . . . 0.0 110.028 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 51.52 22.64 1.59 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.344 -0.848 . . . . 0.0 110.376 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.68 ' HB2' HD13 ' A' ' 46' ' ' LEU . . . -65.93 -46.14 79.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.178 -0.951 . . . . 0.0 110.067 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.488 ' HG3' HG13 ' A' ' 22' ' ' ILE . 12.8 pt-20 -51.97 -28.81 18.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.158 -0.964 . . . . 0.0 110.014 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.488 HG13 ' HG3' ' A' ' 21' ' ' GLU . 64.4 mt -79.34 -47.32 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.292 -0.88 . . . . 0.0 109.992 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.573 ' O ' HD11 ' A' ' 43' ' ' ILE . 1.8 ttmt -57.91 -30.13 65.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.313 -0.867 . . . . 0.0 110.112 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.792 HG22 HD21 ' A' ' 80' ' ' LEU . 42.4 t -78.96 -41.71 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 109.949 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.506 ' HG2' ' NH1' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -55.59 -42.75 75.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.293 -0.88 . . . . 0.0 109.971 179.88 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -76.21 -30.48 58.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.332 -0.855 . . . . 0.0 110.048 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.768 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -66.05 -16.03 63.57 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.26 -0.9 . . . . 0.0 110.014 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.555 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 80.7 p -107.89 1.47 22.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.242 -0.911 . . . . 0.0 110.137 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.401 ' HB3' ' NE2' ' A' ' 73' ' ' HIS . 87.9 p -152.92 60.1 0.79 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.276 -0.89 . . . . 0.0 110.272 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -87.13 170.88 11.12 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 110.161 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -77.96 156.49 79.69 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.913 . . . . 0.0 110.119 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.436 ' O ' ' HB2' ' A' ' 33' ' ' TRP . 12.1 Cg_endo -61.88 -160.86 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.034 1.544 . . . . 0.0 110.282 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.436 ' HB2' ' O ' ' A' ' 32' ' ' PRO . 2.4 m95 62.54 -87.96 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.081 -1.012 . . . . 0.0 110.552 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -138.49 100.28 0.29 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -55.27 -165.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 124.034 1.544 . . . . 0.0 110.476 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.75 93.52 8.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.227 -0.921 . . . . 0.0 110.229 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.98 -24.29 66.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.26 -0.9 . . . . 0.0 110.203 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 11.8 t -98.43 42.55 1.09 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.347 -0.846 . . . . 0.0 110.165 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.768 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER -127.09 -31.19 2.62 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.327 -0.858 . . . . 0.0 110.224 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -58.01 4.0 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.223 -0.923 . . . . 0.0 110.15 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -44.64 -35.19 2.49 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.321 -0.862 . . . . 0.0 110.168 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.508 ' HB3' ' HD3' ' A' ' 23' ' ' LYS . 29.5 mt-10 -68.4 -56.75 7.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 110.11 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.682 HG21 HD11 ' A' ' 80' ' ' LEU . 5.8 mt -48.64 -35.01 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.0 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.647 ' HA ' HD22 ' A' ' 84' ' ' LEU . . . -69.75 -51.7 31.79 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.204 -0.935 . . . . 0.0 109.776 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.424 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 7.0 m-20 -51.59 -21.74 2.79 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.045 -1.034 . . . . 0.0 109.114 179.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.68 HD13 ' HB2' ' A' ' 20' ' ' ALA . 21.4 mt -81.35 -38.48 26.58 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.557 -0.715 . . . . 0.0 110.168 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.559 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 77.3 p -51.07 -42.39 60.54 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.201 -0.937 . . . . 0.0 109.453 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.514 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 74.9 m-85 -43.82 -45.74 7.5 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.732 -0.787 . . . . 0.0 109.191 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.456 ' O ' ' O ' ' A' ' 48' ' ' TYR . 2.1 t-20 -56.61 -159.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.816 0.817 . . . . 0.0 110.32 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.1 t -124.76 -32.9 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-O 121.52 0.676 . . . . 0.0 109.4 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.561 HG12 ' N ' ' A' ' 52' ' ' ALA . 13.1 t -84.6 -72.72 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 CA-C-O 122.059 0.933 . . . . 0.0 109.816 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.561 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -39.14 -41.02 0.78 Allowed 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.482 -178.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.559 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 27.3 t80 -55.56 -53.78 52.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.467 -0.771 . . . . 0.0 109.839 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.72 -27.22 67.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.284 -0.885 . . . . 0.0 109.985 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -82.98 -19.39 37.17 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.286 -0.884 . . . . 0.0 110.018 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.682 ' HA ' HG21 ' A' ' 24' ' ' VAL . 11.2 mt -82.09 -68.8 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.694 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.519 ' SD ' HG13 ' A' ' 92' ' ' VAL . 94.3 mmm -47.27 -34.82 7.03 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.297 -0.877 . . . . 0.0 109.484 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.09 -62.53 1.75 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.432 -0.792 . . . . 0.0 109.85 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.48 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -57.4 -20.18 28.2 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.268 -0.895 . . . . 0.0 109.763 179.532 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.653 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -77.99 -32.99 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.815 . . . . 0.0 109.987 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.475 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 20.4 m95 -76.43 -43.66 39.18 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.905 . . . . 0.0 110.267 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.47 -54.51 46.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.338 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.506 ' NH1' ' HG2' ' A' ' 25' ' ' ARG . 8.4 mtt-85 -69.04 -14.15 62.86 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.23 -0.919 . . . . 0.0 110.184 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.885 HD22 HD11 ' A' ' 106' ' ' LEU . 4.2 mt -77.87 -24.82 48.41 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.215 -0.928 . . . . 0.0 110.189 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.491 ' O ' ' O ' ' A' ' 66' ' ' ASP . 1.5 m-20 -114.62 45.07 1.62 Allowed 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.417 -0.802 . . . . 0.0 109.806 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.491 ' O ' ' O ' ' A' ' 65' ' ' ASN . 9.5 p-10 -56.22 -154.97 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.546 -0.721 . . . . 0.0 110.434 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -123.79 179.89 4.64 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.15 -0.969 . . . . 0.0 110.538 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.58 ' HA3' ' CD2' ' A' ' 111' ' ' TYR . . . -49.46 -36.03 22.92 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.666 -1.373 . . . . 0.0 109.666 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.502 ' C ' ' O ' ' A' ' 68' ' ' GLY . 1.6 tptp -28.77 -70.79 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.979 0 O-C-N 122.312 -0.522 . . . . 0.0 111.439 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.451 ' O ' ' OD2' ' A' ' 66' ' ' ASP . 7.3 m-20 -153.1 108.04 3.19 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.285 -0.885 . . . . 0.0 110.639 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.479 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 25.1 p-90 -66.57 -7.07 17.65 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.372 -0.83 . . . . 0.0 110.043 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.3 -47.49 36.47 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.092 -1.005 . . . . 0.0 109.983 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.401 ' NE2' ' HB3' ' A' ' 29' ' ' SER . 0.0 OUTLIER -52.27 -40.15 61.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.235 -0.916 . . . . 0.0 109.984 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.754 HG11 HD22 ' A' ' 106' ' ' LEU . 49.5 t -63.09 -57.6 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.421 -0.799 . . . . 0.0 110.25 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.569 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 11.2 t80 -44.76 -55.7 5.1 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.456 -0.777 . . . . 0.0 110.161 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.555 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 12.3 mmtt -61.71 -31.43 71.58 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.239 -0.913 . . . . 0.0 110.069 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.828 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -66.98 -24.4 66.04 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.243 -0.91 . . . . 0.0 109.754 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.661 ' HG2' HD21 ' A' ' 64' ' ' LEU . 0.3 OUTLIER -79.44 -31.4 42.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.359 -0.838 . . . . 0.0 110.144 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 93.5 m -68.58 -35.33 77.23 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.253 -0.904 . . . . 0.0 110.328 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.792 HD21 HG22 ' A' ' 24' ' ' VAL . 30.9 tp -73.25 -36.66 66.42 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.206 -0.934 . . . . 0.0 109.764 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.647 ' O ' HD12 ' A' ' 85' ' ' ILE . 3.6 ttp -71.0 -34.75 71.67 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.167 -0.958 . . . . 0.0 109.823 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.548 ' HB2' HD13 ' A' ' 130' ' ' LEU . 16.4 tt0 -75.72 -36.14 60.05 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.319 -0.863 . . . . 0.0 110.81 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.564 ' O ' HG22 ' A' ' 87' ' ' THR . 54.0 t80 -72.18 -42.77 65.49 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.168 -0.957 . . . . 0.0 110.455 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.647 HD22 ' HA ' ' A' ' 44' ' ' ALA . 53.8 mt -71.42 -29.1 64.5 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.154 -0.966 . . . . 0.0 110.304 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.714 HG13 HG12 ' A' ' 92' ' ' VAL . 22.6 mt -64.0 -23.17 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.115 -0.991 . . . . 0.0 109.883 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -98.98 -69.58 0.76 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.946 . . . . 0.0 110.167 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.564 HG22 ' O ' ' A' ' 83' ' ' TYR . 14.3 t -84.39 -27.18 27.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.253 -0.904 . . . . 0.0 110.238 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.514 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -48.51 -73.42 0.34 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 7.2 t 174.35 162.91 0.2 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -1.143 . . . . 0.0 110.199 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -62.27 -12.69 22.0 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.274 -0.891 . . . . 0.0 110.199 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.484 ' NH2' ' HG3' ' A' ' 94' ' ' GLN . 5.9 mmp_? -79.01 -43.05 25.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.259 -0.901 . . . . 0.0 110.265 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.714 HG12 HG13 ' A' ' 85' ' ' ILE . 82.4 t -60.13 -26.0 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.189 -0.944 . . . . 0.0 109.955 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.82 -31.42 23.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.31 -0.869 . . . . 0.0 109.732 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.484 ' HG3' ' NH2' ' A' ' 91' ' ' ARG . 13.3 mm100 -67.95 -48.69 65.18 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.302 -0.874 . . . . 0.0 109.807 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -59.42 -36.88 76.7 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.34 -0.85 . . . . 0.0 109.585 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.712 ' HB3' HD13 ' A' ' 134' ' ' LEU . 44.5 m -56.96 -42.18 79.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.392 -0.817 . . . . 0.0 109.524 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.0 tttp -68.48 -29.07 67.6 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.461 -0.774 . . . . 0.0 109.679 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -83.64 -14.59 51.55 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.387 -0.821 . . . . 0.0 110.077 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -126.21 39.78 3.87 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.364 -0.835 . . . . 0.0 110.271 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 6.1 ttm -65.5 -30.07 70.8 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.186 -0.947 . . . . 0.0 110.206 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.449 ' O ' ' HB ' ' A' ' 105' ' ' THR . 59.7 m-85 -64.39 -12.59 44.29 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.288 -0.883 . . . . 0.0 110.018 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.835 ' O ' HG22 ' A' ' 105' ' ' THR . . . -90.61 -40.67 11.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 110.224 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.443 HG12 HG23 ' A' ' 131' ' ' VAL . 2.4 t -75.94 -21.01 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.322 -0.862 . . . . 0.0 109.911 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -91.53 -26.43 18.77 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.373 -0.83 . . . . 0.0 110.316 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.835 HG22 ' O ' ' A' ' 102' ' ' ALA . 9.2 t -65.4 -16.04 63.21 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.91 . . . . 0.0 110.177 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.885 HD11 HD22 ' A' ' 64' ' ' LEU . 15.4 mt -70.58 -39.85 73.62 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.283 -0.886 . . . . 0.0 110.336 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -49.64 -33.98 16.98 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.331 -0.855 . . . . 0.0 110.195 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -86.72 -25.99 24.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.379 -0.825 . . . . 0.0 110.283 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -45.39 107.69 0.1 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.153 -0.967 . . . . 0.0 110.265 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -140.56 161.86 36.73 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.297 -0.877 . . . . 0.0 110.183 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.58 ' CD2' ' HA3' ' A' ' 68' ' ' GLY . 0.7 OUTLIER -165.85 127.61 1.93 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.257 -0.902 . . . . 0.0 110.104 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.761 HG22 ' O ' ' A' ' 117' ' ' LYS . 46.0 t -148.47 80.7 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.231 -0.918 . . . . 0.0 110.333 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.03 -63.97 1.35 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.341 -0.85 . . . . 0.0 110.065 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.443 ' CG ' ' N ' ' A' ' 115' ' ' ASP . 1.4 ptm85 -72.57 -47.05 51.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.249 -0.907 . . . . 0.0 110.45 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.443 ' N ' ' CG ' ' A' ' 114' ' ' ARG . 0.4 OUTLIER -75.63 -28.35 58.76 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.331 -0.855 . . . . 0.0 110.416 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.576 ' C ' HG13 ' A' ' 112' ' ' VAL . . . 66.82 13.95 62.26 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.761 ' O ' HG22 ' A' ' 112' ' ' VAL . 1.6 tttt -131.69 146.93 52.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.285 -1.126 . . . . 0.0 110.182 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -99.38 114.4 27.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.283 -0.885 . . . . 0.0 110.176 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -133.18 28.79 4.08 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.228 -0.92 . . . . 0.0 110.285 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -91.0 37.46 3.38 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.0 p -81.38 -43.51 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.302 -1.116 . . . . 0.0 110.107 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.9 OUTLIER -50.88 -49.31 59.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.452 -0.78 . . . . 0.0 110.498 -179.838 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.612 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 9.7 p -77.3 -16.0 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.164 -0.96 . . . . 0.0 110.398 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -66.97 0.78 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.197 -0.939 . . . . 0.0 110.599 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.475 ' CG ' ' N ' ' A' ' 126' ' ' LYS . 13.8 pt-20 -60.02 -43.62 95.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.398 -0.814 . . . . 0.0 110.679 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.569 ' HG3' ' CE1' ' A' ' 75' ' ' TYR . 7.4 tmtm? -54.55 -51.64 64.6 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.125 -0.985 . . . . 0.0 110.161 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.564 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -53.99 -41.37 67.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.145 -0.972 . . . . 0.0 110.15 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.423 ' HB3' ' HE2' ' A' ' 128' ' ' LYS . 30.0 ttpt -58.21 -39.93 80.28 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.226 -0.921 . . . . 0.0 110.041 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.459 ' HB2' ' O ' ' A' ' 126' ' ' LYS . 28.9 mt-30 -57.3 -48.61 78.5 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.305 -0.872 . . . . 0.0 110.174 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.58 ' O ' HD12 ' A' ' 134' ' ' LEU . 9.2 tp -57.59 -28.78 63.92 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.172 -0.955 . . . . 0.0 109.677 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.443 HG23 HG12 ' A' ' 103' ' ' VAL . 43.1 t -78.29 -27.9 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.343 -0.848 . . . . 0.0 109.513 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.787 ' HB1' ' OD1' ' A' ' 136' ' ' ASP . . . -72.61 -53.35 12.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.461 -0.774 . . . . 0.0 110.252 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.2 mp -56.13 -32.71 64.48 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.231 -0.918 . . . . 0.0 110.176 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.712 HD13 ' HB3' ' A' ' 96' ' ' CYS . 31.4 mt -79.42 -23.69 43.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 0.0 110.192 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -164.38 64.87 0.15 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.24 -0.913 . . . . 0.0 110.122 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.787 ' OD1' ' HB1' ' A' ' 132' ' ' ALA . 0.3 OUTLIER -81.54 -66.37 0.9 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 110.231 -179.82 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.465 ' HB3' ' O ' ' A' ' 136' ' ' ASP . 14.0 tp10 57.33 89.59 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.174 -0.954 . . . . 0.0 110.216 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -102.13 -167.61 1.43 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.323 -0.861 . . . . 0.0 110.251 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -77.68 137.48 38.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.318 -0.864 . . . . 0.0 110.211 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.8 79.22 1.42 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.216 -0.928 . . . . 0.0 110.171 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.61 -86.12 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.199 -0.938 . . . . 0.0 110.189 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -130.51 -175.28 3.6 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 144' ' ' ARG . 7.1 mt-10 -119.32 83.97 2.12 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.294 -0.879 . . . . 0.0 110.279 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.432 ' CB ' ' O ' ' A' ' 143' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.26 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 8.6 t -104.09 162.61 13.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.277 -1.131 . . . . 0.0 110.164 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.52 130.46 50.91 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 0.0 110.205 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -123.55 49.21 1.74 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.33 -0.856 . . . . 0.0 110.291 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.9 tpt -73.56 115.54 13.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 110.242 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.87 115.54 24.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.163 -0.96 . . . . 0.0 110.262 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 36.1 p -89.93 119.0 29.92 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.27 -0.894 . . . . 0.0 110.166 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.1 m -66.86 -160.97 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.29 -0.881 . . . . 0.0 110.118 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.5 m -129.1 165.77 20.58 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.214 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -104.65 34.08 3.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.306 -0.871 . . . . 0.0 110.144 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -102.38 26.75 7.44 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 110.277 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.8 mtt180 -150.44 145.65 26.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.193 -0.942 . . . . 0.0 110.243 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -91.71 166.46 12.77 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.276 -0.89 . . . . 0.0 110.211 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.5 ptt? -90.45 175.07 7.22 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.294 -0.879 . . . . 0.0 110.13 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.98 -166.99 1.74 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 110.199 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -132.44 59.49 1.72 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.9 . . . . 0.0 110.129 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 tt -85.02 -175.1 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.308 -0.87 . . . . 0.0 110.215 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.1 t -75.45 145.84 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.147 -0.971 . . . . 0.0 110.278 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.427 ' O ' ' HB2' ' A' ' 16' ' ' ASN . 36.5 m-70 -120.43 163.39 17.98 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.23 -0.919 . . . . 0.0 110.158 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 15' ' ' HIS . 2.8 t30 -177.26 91.74 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.199 -0.938 . . . . 0.0 110.241 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.532 ' O ' ' CB ' ' A' ' 18' ' ' SER . 1.4 p90 -50.05 171.74 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.234 -0.916 . . . . 0.0 110.193 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.532 ' CB ' ' O ' ' A' ' 17' ' ' TYR . 1.3 m 76.08 -73.33 0.09 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.611 -0.68 . . . . 0.0 110.545 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.534 ' HG2' HD12 ' A' ' 22' ' ' ILE . 38.0 mt-10 51.07 32.01 7.17 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.9 -1.125 . . . . 0.0 110.122 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.896 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -66.68 -56.54 10.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.265 -0.897 . . . . 0.0 110.221 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.412 ' C ' ' O ' ' A' ' 20' ' ' ALA . 15.1 pt-20 -42.97 -29.55 0.34 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.306 -0.871 . . . . 0.0 110.197 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.534 HD12 ' HG2' ' A' ' 19' ' ' GLU . 36.4 mt -79.78 -48.73 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.255 -0.903 . . . . 0.0 110.121 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.55 ' O ' HD11 ' A' ' 43' ' ' ILE . 2.6 mmtm -50.46 -35.75 30.34 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 0.0 110.037 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.654 HG13 ' CD2' ' A' ' 80' ' ' LEU . 98.3 t -72.46 -48.15 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.333 -0.855 . . . . 0.0 110.106 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.71 -51.2 40.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.176 -0.952 . . . . 0.0 110.009 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -65.69 -29.17 69.68 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.936 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.789 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -74.28 -19.51 60.47 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.275 -0.891 . . . . 0.0 110.022 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 76' ' ' LYS . 34.5 p -120.42 62.55 0.85 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.328 -0.858 . . . . 0.0 110.262 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.7 t -174.19 -36.26 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.241 -0.912 . . . . 0.0 110.16 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -153.65 152.42 30.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.267 -0.895 . . . . 0.0 110.263 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.534 ' N ' ' CD ' ' A' ' 32' ' ' PRO . 0.5 OUTLIER -158.4 50.1 0.37 Allowed Pre-proline 0 N--CA 1.492 1.651 0 O-C-N 121.286 -0.884 . . . . 0.0 110.243 179.941 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.534 ' CD ' ' N ' ' A' ' 31' ' ' ASP . 17.8 Cg_endo -65.41 -176.32 0.51 Allowed 'Trans proline' 0 C--N 1.305 -1.732 0 O-C-N 124.012 1.532 . . . . 0.0 110.502 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -91.69 -154.05 0.35 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.348 -0.845 . . . . 0.0 110.733 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 146.57 -177.9 24.59 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -62.52 -64.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 123.985 1.518 . . . . 0.0 110.326 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.54 105.33 6.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.243 -0.91 . . . . 0.0 110.131 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.4 t -89.15 148.03 23.88 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.269 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -172.62 101.2 0.14 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.274 -0.891 . . . . 0.0 110.152 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.789 HD21 ' HB2' ' A' ' 27' ' ' ALA . 1.3 tp -139.62 -42.28 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.237 -0.914 . . . . 0.0 110.234 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.5 mtt -60.03 -51.9 67.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.157 -0.964 . . . . 0.0 110.195 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 98.0 p -52.78 -26.32 13.97 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.201 -0.937 . . . . 0.0 110.141 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 8.3 mm-40 -78.08 -54.99 5.65 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.251 -0.906 . . . . 0.0 110.2 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.766 HG21 HD11 ' A' ' 80' ' ' LEU . 54.6 mt -51.83 -38.11 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.187 -0.945 . . . . 0.0 109.998 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.492 ' CA ' HD22 ' A' ' 84' ' ' LEU . . . -68.61 -53.16 24.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.09 -1.006 . . . . 0.0 109.269 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.5 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 4.9 t70 -51.25 -22.06 2.49 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.13 -0.981 . . . . 0.0 109.147 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.896 HD22 ' HB2' ' A' ' 20' ' ' ALA . 8.5 mt -80.15 -39.72 28.81 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.5 -0.75 . . . . 0.0 110.053 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.782 HG21 ' HB3' ' A' ' 84' ' ' LEU . 81.7 p -48.54 -38.98 21.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.094 -1.004 . . . . 0.0 109.26 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.585 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 63.3 m-85 -45.28 -49.62 12.45 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.401 -0.92 . . . . 0.0 109.442 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.544 ' O ' ' C ' ' A' ' 50' ' ' VAL . 49.2 m-20 -70.49 92.29 0.82 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.672 -0.642 . . . . 0.0 110.8 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.544 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -12.16 -57.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.21 178.095 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.551 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.6 t -62.54 -64.85 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.07 -1.019 . . . . 0.0 109.888 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.632 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -38.03 -40.98 0.53 Allowed 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.302 0.572 . . . . 0.0 110.568 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.61 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 29.1 t80 -64.81 -57.48 8.77 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.453 -0.779 . . . . 0.0 110.265 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -26.82 9.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.213 -0.929 . . . . 0.0 110.016 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -84.17 -31.72 24.99 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.238 -0.914 . . . . 0.0 109.981 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.824 HD11 ' HB3' ' A' ' 46' ' ' LEU . 17.0 mt -74.66 -68.48 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.396 -0.815 . . . . 0.0 110.117 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.61 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 14.1 mmm -43.8 -38.83 3.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.267 -0.896 . . . . 0.0 109.729 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.83 -59.87 3.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.394 -0.816 . . . . 0.0 109.951 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 16.4 mmt -60.11 -21.94 62.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.263 -0.898 . . . . 0.0 109.896 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.666 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -76.92 -28.28 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.425 -0.797 . . . . 0.0 109.878 179.898 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 14.4 m95 -81.99 -29.54 32.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.276 -0.89 . . . . 0.0 110.373 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -58.54 3.4 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.378 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -64.57 -24.02 67.46 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.185 -0.947 . . . . 0.0 110.139 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.99 HD22 HD11 ' A' ' 106' ' ' LEU . 5.6 mt -66.14 -16.28 63.83 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.0 110.392 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.473 ' O ' ' O ' ' A' ' 66' ' ' ASP . 22.9 m-20 -113.59 43.48 1.77 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.293 -0.879 . . . . 0.0 110.058 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.578 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -53.82 -166.78 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.374 -0.829 . . . . 0.0 110.297 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.426 ' O ' ' C ' ' A' ' 68' ' ' GLY . 0.2 OUTLIER -151.32 -169.45 3.38 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 110.474 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.426 ' C ' ' O ' ' A' ' 67' ' ' HIS . . . 42.49 -128.75 4.86 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.55 16.7 19.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.397 -1.061 . . . . 0.0 110.207 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -86.44 35.74 0.67 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.323 -0.86 . . . . 0.0 110.376 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.435 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 19.6 p-90 -63.3 -10.31 15.63 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.251 -0.906 . . . . 0.0 110.381 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 39.2 mtt85 -48.93 -46.21 42.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.107 -0.996 . . . . 0.0 110.092 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 68.2 m80 -58.73 -48.88 79.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.227 -0.92 . . . . 0.0 110.107 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.744 HG12 HG13 ' A' ' 123' ' ' VAL . 16.9 t -46.62 -44.72 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.269 -0.895 . . . . 0.0 110.181 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.51 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 4.0 t80 -55.72 -54.87 39.02 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.251 -0.906 . . . . 0.0 110.283 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.556 ' O ' HG22 ' A' ' 28' ' ' THR . 0.2 OUTLIER -71.17 -9.11 57.52 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.898 -1.126 . . . . 0.0 109.52 179.525 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.934 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -79.16 -70.2 0.52 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.395 -0.815 . . . . 0.0 110.941 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.574 ' HE1' HG13 ' A' ' 123' ' ' VAL . 0.7 OUTLIER -56.63 -26.7 56.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.114 -0.991 . . . . 0.0 110.105 -179.487 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.426 ' O ' ' C ' ' A' ' 80' ' ' LEU . 61.2 m -63.65 -65.2 0.71 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.031 -1.043 . . . . 0.0 109.439 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.766 HD11 HG21 ' A' ' 43' ' ' ILE . 10.6 tp -42.67 -59.0 2.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.502 -0.748 . . . . 0.0 109.316 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.483 ' HE2' ' SG ' ' A' ' 96' ' ' CYS . 19.4 ttt -42.9 -46.08 5.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.359 -0.838 . . . . 0.0 109.836 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.653 ' HB2' HD12 ' A' ' 130' ' ' LEU . 40.8 tt0 -58.81 -48.57 80.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.356 -0.84 . . . . 0.0 109.779 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.424 ' CE1' HG21 ' A' ' 87' ' ' THR . 22.9 t80 -54.48 -37.39 65.2 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.41 -0.806 . . . . 0.0 110.183 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.92 ' HB2' HG11 ' A' ' 92' ' ' VAL . 2.6 mt -74.67 -28.45 60.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.273 -0.892 . . . . 0.0 110.007 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.994 HD13 HD11 ' A' ' 134' ' ' LEU . 32.2 mt -70.22 -26.05 28.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.037 -1.039 . . . . 0.0 109.962 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -88.77 -68.68 0.75 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.261 -0.9 . . . . 0.0 110.383 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.438 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 14.5 t -95.1 -22.73 17.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.201 -0.937 . . . . 0.0 110.49 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.585 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -47.68 -77.17 0.12 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 88' ' ' GLY . 6.2 p -178.71 171.45 1.48 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.169 -1.195 . . . . 0.0 110.301 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -71.47 -13.8 61.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.272 -0.892 . . . . 0.0 110.219 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 15.7 mmt180 -79.48 -41.51 27.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.25 -0.906 . . . . 0.0 109.989 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.92 HG11 ' HB2' ' A' ' 84' ' ' LEU . 93.3 t -56.26 -33.24 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.263 -0.898 . . . . 0.0 109.865 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.47 ' O ' ' HB3' ' A' ' 96' ' ' CYS . 1.6 t -76.15 -40.97 51.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.289 -0.882 . . . . 0.0 109.849 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -57.18 -56.58 19.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -0.869 . . . . 0.0 109.861 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -52.92 -38.75 62.22 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.361 -0.837 . . . . 0.0 109.568 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.483 ' SG ' ' HE2' ' A' ' 81' ' ' MET . 48.9 t -54.67 -43.84 72.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.359 -0.838 . . . . 0.0 109.693 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -65.44 -35.81 82.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.352 -0.842 . . . . 0.0 109.675 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -78.24 -12.68 60.01 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.421 -0.799 . . . . 0.0 109.842 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -134.04 30.41 3.65 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.458 -0.776 . . . . 0.0 110.119 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 4.9 ptt? -62.99 -24.92 68.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.178 -0.951 . . . . 0.0 110.009 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.469 ' O ' ' HB ' ' A' ' 105' ' ' THR . 2.7 m-85 -65.76 -23.84 66.82 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.213 -0.929 . . . . 0.0 109.99 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.991 ' O ' HG22 ' A' ' 105' ' ' THR . . . -78.37 -40.89 34.91 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.381 -0.825 . . . . 0.0 110.193 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.701 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 5.3 t -72.17 -27.64 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.306 -0.871 . . . . 0.0 110.151 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.78 ' HG2' HG21 ' A' ' 131' ' ' VAL . 3.4 mm100 -86.84 -29.36 22.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.327 -0.858 . . . . 0.0 110.372 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.991 HG22 ' O ' ' A' ' 102' ' ' ALA . 11.0 t -57.59 -19.38 25.45 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.236 -0.915 . . . . 0.0 110.232 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.99 HD11 HD22 ' A' ' 64' ' ' LEU . 20.4 mt -68.97 -40.65 78.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.251 -0.906 . . . . 0.0 110.255 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 14.9 ttpp -52.64 -20.67 3.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.235 -0.916 . . . . 0.0 110.196 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -103.1 -26.47 13.03 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.27 -0.894 . . . . 0.0 110.364 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.41 115.93 6.18 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.232 -0.917 . . . . 0.0 110.342 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -158.43 137.31 11.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 110.144 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.416 ' C ' HG23 ' A' ' 112' ' ' VAL . 2.7 t80 -115.54 137.08 52.43 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.348 -0.845 . . . . 0.0 110.128 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.71 ' O ' HG12 ' A' ' 112' ' ' VAL . 69.3 t -147.76 18.44 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.243 -0.911 . . . . 0.0 110.227 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.43 -169.29 0.11 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.254 -0.903 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.22 -47.53 62.3 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.257 -0.902 . . . . 0.0 110.234 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -149.58 132.74 16.34 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.301 -0.874 . . . . 0.0 110.179 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.42 ' C ' ' CG1' ' A' ' 112' ' ' VAL . . . 175.19 -146.43 8.36 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.407 ' N ' HG13 ' A' ' 112' ' ' VAL . 1.3 ptmm? -139.44 158.37 44.25 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.236 -1.155 . . . . 0.0 110.287 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -45.68 144.41 1.67 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.212 -0.93 . . . . 0.0 110.305 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -92.59 -48.8 6.43 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.278 -0.889 . . . . 0.0 110.208 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -135.79 99.88 0.33 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.564 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.2 p -79.88 -42.14 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.317 -1.108 . . . . 0.0 110.071 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.564 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.6 m-80 -36.6 -30.11 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.218 0.533 . . . . 0.0 110.64 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.744 HG13 HG12 ' A' ' 74' ' ' VAL . 12.6 t -72.7 -62.12 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.339 -0.851 . . . . 0.0 110.283 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -44.47 -43.82 8.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.251 -0.905 . . . . 0.0 110.658 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.539 ' HG3' ' N ' ' A' ' 126' ' ' LYS . 10.0 pt-20 -75.39 -32.22 60.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.276 -0.89 . . . . 0.0 110.717 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.539 ' N ' ' HG3' ' A' ' 125' ' ' GLU . 33.4 tptt -62.07 -52.89 62.08 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.97 -1.081 . . . . 0.0 110.247 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.701 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -58.26 -41.42 84.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.302 -0.874 . . . . 0.0 110.267 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 11.6 tttm -59.67 -38.29 81.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.23 -0.919 . . . . 0.0 110.305 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -62.32 -40.62 96.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.281 -0.887 . . . . 0.0 110.6 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.653 HD12 ' HB2' ' A' ' 82' ' ' GLU . 7.9 tt -61.17 -40.39 93.71 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.08 -1.012 . . . . 0.0 110.508 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.78 HG21 ' HG2' ' A' ' 104' ' ' GLN . 54.0 t -77.45 -24.96 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.321 -0.862 . . . . 0.0 110.475 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.0 -52.61 18.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.234 -0.916 . . . . 0.0 110.573 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.742 HD12 ' C ' ' A' ' 133' ' ' LEU . 3.5 pp -66.31 -22.16 66.28 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.181 -0.95 . . . . 0.0 110.371 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.994 HD11 HD13 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -83.02 -69.22 0.64 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.268 -0.895 . . . . 0.0 110.466 -179.777 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.441 ' CD ' ' O ' ' A' ' 135' ' ' ARG . 0.1 OUTLIER -88.51 49.56 1.81 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.185 -0.947 . . . . 0.0 110.226 -179.913 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -82.11 -16.92 48.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.244 -0.91 . . . . 0.0 110.323 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.78 119.92 5.15 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.194 -0.941 . . . . 0.0 110.216 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -169.55 40.69 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.231 -0.918 . . . . 0.0 110.384 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.9 ttm105 -102.54 80.53 1.94 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.178 -0.951 . . . . 0.0 110.333 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -132.42 13.01 4.57 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.28 -0.887 . . . . 0.0 110.2 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.86 109.58 3.46 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.248 -0.908 . . . . 0.0 110.154 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -109.77 27.49 9.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.272 -0.892 . . . . 0.0 110.269 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -138.65 -171.43 3.06 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.244 -0.91 . . . . 0.0 110.193 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.169 -0.957 . . . . 0.0 110.224 -179.999 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -2' ' ' SER . . . . . 0.409 ' O ' ' CB ' ' A' ' -1' ' ' SER . 0.5 OUTLIER -147.08 60.75 1.18 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.319 -1.106 . . . . 0.0 110.092 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' -1' ' ' SER . . . . . 0.409 ' CB ' ' O ' ' A' ' -2' ' ' SER . 1.2 m 63.45 153.52 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.251 -0.906 . . . . 0.0 110.087 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 15.8 mmt-85 -142.77 -42.11 0.32 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 110.307 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.8 ttm -58.1 136.29 57.17 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.161 -0.962 . . . . 0.0 110.209 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.3 m -153.19 -87.48 0.06 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.347 -0.846 . . . . 0.0 110.17 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 p -113.34 146.84 38.78 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.921 . . . . 0.0 110.176 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.17 42.26 1.1 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.044 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.437 ' O ' ' O ' ' A' ' 6' ' ' LEU . 13.4 m -122.12 -163.15 1.05 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.337 -0.852 . . . . 0.0 110.216 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.581 HD23 ' O ' ' A' ' 7' ' ' ARG . 7.5 tt 51.03 100.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.211 -0.931 . . . . 0.0 110.299 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.581 ' O ' HD23 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -61.32 175.92 0.52 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.286 -0.884 . . . . 0.0 110.223 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.21 -36.36 1.31 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.194 -0.941 . . . . 0.0 110.272 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.0 107.17 0.59 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.154 -0.966 . . . . 0.0 110.27 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -89.61 -153.86 0.29 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.243 -0.91 . . . . 0.0 110.275 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.1 mtpt -69.17 -52.94 22.97 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.277 -0.89 . . . . 0.0 110.145 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.617 ' C ' HD12 ' A' ' 13' ' ' ILE . 0.7 OUTLIER -149.38 -161.91 1.44 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -0.91 . . . . 0.0 110.139 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.701 HD12 ' N ' ' A' ' 13' ' ' ILE . 5.2 mp -135.06 173.36 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.167 -0.958 . . . . 0.0 110.205 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.564 ' N ' HG22 ' A' ' 13' ' ' ILE . 3.2 m -116.25 165.87 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.22 -0.925 . . . . 0.0 110.227 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -136.11 -178.97 5.39 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -0.907 . . . . 0.0 110.302 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -137.64 80.72 1.82 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.289 -0.882 . . . . 0.0 110.048 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.558 ' CD2' ' HB2' ' A' ' 18' ' ' SER . 32.4 p90 -58.3 -163.28 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 0.0 110.184 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.558 ' HB2' ' CD2' ' A' ' 17' ' ' TYR . 1.1 t 64.29 54.04 1.64 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.191 -0.943 . . . . 0.0 110.165 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -126.56 5.96 6.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.313 -0.867 . . . . 0.0 110.149 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.913 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -60.42 -45.58 93.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.266 -0.896 . . . . 0.0 110.286 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.501 ' HG3' HG13 ' A' ' 22' ' ' ILE . 9.4 pt-20 -43.39 -40.94 3.93 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 110.051 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.501 HG13 ' HG3' ' A' ' 21' ' ' GLU . 37.3 mt -69.45 -40.46 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.2 -0.938 . . . . 0.0 109.968 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 1.0 OUTLIER -59.53 -61.72 2.41 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.287 -0.883 . . . . 0.0 110.122 179.814 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.829 HG13 HD23 ' A' ' 80' ' ' LEU . 84.2 t -48.35 -33.33 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.241 -0.912 . . . . 0.0 110.052 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.415 ' HB3' ' O ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER -64.6 -46.39 82.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.374 -0.829 . . . . 0.0 110.244 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.01 -17.13 61.03 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.384 -0.822 . . . . 0.0 110.19 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.942 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -79.7 -28.1 40.67 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 110.152 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 77.4 p -118.36 45.26 2.05 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.24 -0.912 . . . . 0.0 110.142 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.4 t -168.69 36.48 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.255 -0.903 . . . . 0.0 110.145 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -164.09 146.06 8.98 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.234 -0.916 . . . . 0.0 110.068 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.11 148.26 77.99 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.218 -0.926 . . . . 0.0 110.267 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.404 ' O ' ' HB2' ' A' ' 33' ' ' TRP . 19.1 Cg_endo -64.82 -161.63 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 124.014 1.534 . . . . 0.0 110.287 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.404 ' HB2' ' O ' ' A' ' 32' ' ' PRO . 1.3 m95 63.03 171.24 0.15 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.222 -0.924 . . . . 0.0 110.44 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.422 ' O ' ' O ' ' A' ' 35' ' ' PRO . . . 85.17 -176.39 50.31 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.529 -1.429 . . . . 0.0 109.529 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.449 ' O ' ' CB ' ' A' ' 36' ' ' SER . 23.7 Cg_exo -59.06 -143.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.664 0 O-C-N 124.016 1.535 . . . . 0.0 110.397 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.449 ' CB ' ' O ' ' A' ' 35' ' ' PRO . 0.1 OUTLIER 66.27 108.19 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.355 -0.841 . . . . 0.0 110.162 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.9 t -63.72 -78.45 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.218 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.5 m -149.89 108.57 3.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.148 -0.97 . . . . 0.0 110.243 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.942 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER -83.96 -25.18 30.26 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.935 . . . . 0.0 110.18 179.901 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.0 mtp -66.99 -52.36 43.57 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.275 -0.891 . . . . 0.0 110.149 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 t -55.04 -32.08 61.6 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.269 -0.894 . . . . 0.0 110.221 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.94 -46.4 52.7 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.257 -0.902 . . . . 0.0 110.218 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.468 ' O ' ' HB2' ' A' ' 46' ' ' LEU . 68.6 mt -59.81 -31.01 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.129 -0.982 . . . . 0.0 109.853 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.577 ' HA ' HD22 ' A' ' 84' ' ' LEU . . . -70.65 -51.43 27.94 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.135 -0.978 . . . . 0.0 109.434 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.435 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 38.4 t0 -52.68 -21.08 3.6 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.076 -1.015 . . . . 0.0 108.886 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.913 HD13 ' CB ' ' A' ' 20' ' ' ALA . 15.5 mt -79.81 -38.31 33.23 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.488 -0.757 . . . . 0.0 110.247 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.535 ' HA ' ' CA ' ' A' ' 53' ' ' PHE . 55.3 p -52.49 -45.41 66.15 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.946 -1.096 . . . . 0.0 109.063 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.435 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 90.4 m-85 -43.58 -41.98 4.84 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.38 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.535 ' O ' ' N ' ' A' ' 51' ' ' VAL . 0.3 OUTLIER -73.51 91.43 1.81 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.577 -0.702 . . . . 0.0 110.183 179.531 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.532 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.09 -59.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.571 178.309 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.544 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -65.05 -65.78 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.104 -0.998 . . . . 0.0 110.203 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.811 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -35.64 -46.56 0.43 Allowed 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.099 -177.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.535 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 4.7 t80 -55.4 -56.75 16.58 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.279 -0.888 . . . . 0.0 110.289 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.488 ' O ' ' HB2' ' A' ' 58' ' ' SER . 88.9 p -52.1 -38.88 58.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.206 -0.934 . . . . 0.0 110.245 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -70.14 -29.73 66.73 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.431 -0.793 . . . . 0.0 110.39 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.79 ' HA ' HG21 ' A' ' 24' ' ' VAL . 11.2 mt -77.55 -70.28 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.187 -0.946 . . . . 0.0 110.281 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.54 ' HG3' ' NE1' ' A' ' 61' ' ' TRP . 1.9 tpt -47.19 -34.6 6.48 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.144 -0.972 . . . . 0.0 110.031 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 54' ' ' SER . 32.5 t -57.23 -61.82 2.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.333 -0.854 . . . . 0.0 110.108 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.4 mmt -58.21 -26.62 63.06 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.199 -0.938 . . . . 0.0 109.941 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.773 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -71.6 -31.07 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.299 -0.876 . . . . 0.0 109.88 179.747 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.54 ' NE1' ' HG3' ' A' ' 57' ' ' MET . 11.0 m95 -77.47 -42.93 34.07 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.277 -0.889 . . . . 0.0 110.386 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -60.5 3.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.283 -0.886 . . . . 0.0 110.605 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -13.04 57.96 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.187 -0.946 . . . . 0.0 110.578 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 1.022 HD22 HD11 ' A' ' 106' ' ' LEU . 2.4 mt -74.99 -13.43 60.51 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.162 -0.961 . . . . 0.0 110.576 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -108.3 38.99 2.07 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.15 -0.969 . . . . 0.0 110.379 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.744 ' OD2' HG23 ' A' ' 74' ' ' VAL . 75.8 m-20 -50.95 136.51 22.75 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.179 -0.951 . . . . 0.0 110.048 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.464 ' O ' ' O ' ' A' ' 66' ' ' ASP . 4.9 m-70 -53.08 -169.39 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.587 -0.696 . . . . 0.0 110.177 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.538 ' HA3' ' CD2' ' A' ' 111' ' ' TYR . . . -86.08 58.96 4.74 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 68' ' ' GLY . 28.8 mttp -150.96 -81.9 0.1 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.378 -1.072 . . . . 0.0 110.148 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -84.77 73.93 10.54 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.285 -0.884 . . . . 0.0 110.511 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.47 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 33.7 p-90 -71.44 -13.64 61.9 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.24 -0.912 . . . . 0.0 110.096 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.411 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 14.9 mtt180 -50.69 -42.98 57.46 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.242 -0.911 . . . . 0.0 109.945 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.524 ' CB ' ' OD2' ' A' ' 66' ' ' ASP . 1.3 m170 -54.56 -39.62 67.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.321 -0.862 . . . . 0.0 109.835 179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.756 HG11 ' CG1' ' A' ' 123' ' ' VAL . 42.7 t -60.64 -51.27 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.314 -0.866 . . . . 0.0 109.759 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 74' ' ' VAL . 2.2 t80 -41.79 -61.55 1.08 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.393 -0.817 . . . . 0.0 110.261 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.03 -28.98 70.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.271 -0.893 . . . . 0.0 110.195 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.949 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -61.24 -70.32 0.19 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.185 -0.947 . . . . 0.0 110.166 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.656 ' HE2' HG12 ' A' ' 74' ' ' VAL . 3.0 ptp -50.49 -26.61 5.33 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.398 -0.814 . . . . 0.0 110.023 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 61.2 m -66.68 -47.27 72.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.272 -0.892 . . . . 0.0 109.937 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.829 HD23 HG13 ' A' ' 24' ' ' VAL . 16.6 tp -64.22 -29.7 70.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.428 -0.795 . . . . 0.0 109.838 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.788 ' HG2' HD21 ' A' ' 130' ' ' LEU . 5.2 ttp -71.86 -35.17 69.74 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.333 -0.854 . . . . 0.0 109.893 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.44 ' CB ' HD13 ' A' ' 130' ' ' LEU . 46.2 tt0 -70.87 -56.41 6.34 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.298 -0.876 . . . . 0.0 110.22 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -52.56 -45.06 66.25 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.289 -0.882 . . . . 0.0 110.74 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.608 ' CB ' HG11 ' A' ' 92' ' ' VAL . 59.8 mt -73.0 -29.68 63.21 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.935 . . . . 0.0 110.791 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.635 HG13 HG12 ' A' ' 92' ' ' VAL . 8.5 mt -61.19 -14.28 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 120.859 -1.151 . . . . 0.0 109.635 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 43.0 mttt -107.03 -77.76 0.59 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.241 -0.912 . . . . 0.0 109.97 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.459 HG23 ' HB1' ' A' ' 44' ' ' ALA . 13.5 t -82.49 2.88 30.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.881 . . . . 0.0 110.019 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -93.39 30.06 7.66 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.2 OUTLIER 75.74 148.59 0.1 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.58 -0.953 . . . . 0.0 110.41 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.3 -9.72 13.01 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.48 -0.763 . . . . 0.0 110.542 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 -71.46 -43.13 67.19 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.184 -0.948 . . . . 0.0 109.836 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.635 HG12 HG13 ' A' ' 85' ' ' ILE . 99.3 t -55.98 -32.85 34.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.481 -0.762 . . . . 0.0 110.324 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.514 ' OG ' HG23 ' A' ' 85' ' ' ILE . 1.1 t -81.56 -41.81 21.05 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.239 -0.913 . . . . 0.0 110.27 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -55.12 -54.18 46.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.0 109.961 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.483 ' HG2' ' HE2' ' A' ' 57' ' ' MET . 11.1 tt0 -54.18 -39.46 66.62 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.408 -0.807 . . . . 0.0 109.657 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.554 ' SG ' HD11 ' A' ' 134' ' ' LEU . 0.1 OUTLIER -55.26 -43.01 74.27 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.318 -0.864 . . . . 0.0 109.644 179.527 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -68.12 -31.22 70.66 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.435 -0.791 . . . . 0.0 109.704 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -75.62 -19.84 58.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.432 -0.793 . . . . 0.0 109.798 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -122.07 40.67 3.59 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.411 -0.806 . . . . 0.0 110.033 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.458 ' O ' ' HB2' ' A' ' 104' ' ' GLN . 0.2 OUTLIER -56.15 -22.64 29.92 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.27 -0.894 . . . . 0.0 110.343 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.443 ' N ' ' HG2' ' A' ' 100' ' ' MET . 2.3 m-30 -76.57 -32.26 58.06 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -0.916 . . . . 0.0 110.256 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.816 ' O ' HG22 ' A' ' 105' ' ' THR . . . -74.5 -39.41 62.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 110.219 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.733 HG23 ' CE ' ' A' ' 81' ' ' MET . 3.2 p -74.26 -42.43 50.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 O-C-N 121.287 -0.883 . . . . 0.0 109.304 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.568 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 67.3 mt-30 -71.94 -20.16 61.8 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.596 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.816 HG22 ' O ' ' A' ' 102' ' ' ALA . 5.1 t -53.34 -28.28 27.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.951 -1.093 . . . . 0.0 110.056 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 1.022 HD11 HD22 ' A' ' 64' ' ' LEU . 75.5 mt -71.94 -35.32 69.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.874 . . . . 0.0 110.263 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.511 ' HA ' ' HG2' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -53.98 -25.94 23.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.234 -0.916 . . . . 0.0 110.087 179.902 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.469 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 53.8 t0 -108.83 -9.56 15.17 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.351 -0.843 . . . . 0.0 110.233 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.497 ' C ' ' CD1' ' A' ' 109' ' ' PHE . 1.6 t80 -68.11 101.0 1.07 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.274 -0.892 . . . . 0.0 110.257 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 15.3 mt-30 -136.33 163.32 30.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.322 -0.862 . . . . 0.0 110.257 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.552 ' C ' HG23 ' A' ' 112' ' ' VAL . 0.2 OUTLIER -172.45 118.2 0.36 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.218 -0.926 . . . . 0.0 110.161 180.0 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.552 HG23 ' C ' ' A' ' 111' ' ' TYR . 40.8 t -151.9 72.43 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.224 -0.923 . . . . 0.0 110.232 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.432 ' OD2' ' CE1' ' A' ' 111' ' ' TYR . 10.4 m-20 -121.61 -66.94 1.0 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.27 -0.894 . . . . 0.0 110.168 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.467 ' CD ' ' OD1' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -51.74 -48.12 63.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.22 -0.925 . . . . 0.0 110.284 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.467 ' OD1' ' CD ' ' A' ' 114' ' ' ARG . 1.1 m-20 -86.5 -42.9 13.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.283 -0.886 . . . . 0.0 110.181 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.419 ' HA2' HG12 ' A' ' 112' ' ' VAL . . . 78.22 6.25 87.63 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -108.19 124.85 50.9 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.232 -1.158 . . . . 0.0 110.21 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.46 92.84 0.21 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.224 -0.923 . . . . 0.0 110.222 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -126.55 0.32 6.86 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.206 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -104.95 26.09 23.36 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.563 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.7 p -88.32 -42.63 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.232 -1.158 . . . . 0.0 110.231 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.563 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.2 m-20 -37.43 -28.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.76 -0.588 . . . . 0.0 110.76 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.756 ' CG1' HG11 ' A' ' 74' ' ' VAL . 7.1 t -85.29 -64.73 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.243 -0.91 . . . . 0.0 110.211 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.511 ' HG2' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -40.6 -36.27 0.57 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.146 -0.971 . . . . 0.0 111.05 -179.467 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.47 ' O ' ' HB3' ' A' ' 128' ' ' LYS . 17.5 mm-40 -81.36 -50.81 9.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.119 -0.988 . . . . 0.0 111.191 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.452 ' HB3' ' SD ' ' A' ' 78' ' ' MET . 0.0 OUTLIER -53.59 -56.78 14.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.075 -1.016 . . . . 0.0 109.73 -179.786 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.571 ' O ' HG23 ' A' ' 131' ' ' VAL . . . -53.78 -41.36 67.16 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.398 -0.814 . . . . 0.0 110.058 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -50.78 -40.7 55.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.125 -0.984 . . . . 0.0 110.175 179.917 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -65.21 -53.1 49.64 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 110.177 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.788 HD21 ' HG2' ' A' ' 81' ' ' MET . 17.1 tp -48.58 -32.03 7.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.216 -0.928 . . . . 0.0 110.13 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 127' ' ' ALA . 21.4 t -78.73 -35.05 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.391 -0.818 . . . . 0.0 110.106 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.78 -52.71 55.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 0.0 110.185 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 136' ' ' ASP . 1.0 OUTLIER -66.19 -44.6 83.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.3 -0.875 . . . . 0.0 110.186 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.554 HD11 ' SG ' ' A' ' 96' ' ' CYS . 5.9 mt -46.49 -52.91 12.28 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.246 -0.909 . . . . 0.0 110.346 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 -93.45 54.51 2.07 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.292 -0.88 . . . . 0.0 110.418 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.436 ' HB2' ' O ' ' A' ' 133' ' ' LEU . 0.2 OUTLIER -85.57 -18.91 31.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.192 -0.943 . . . . 0.0 110.11 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.58 149.2 49.27 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 0.0 110.366 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 139' ' ' ARG . 36.5 t0 -147.42 90.45 1.87 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.307 -0.87 . . . . 0.0 110.065 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 138' ' ' ASP . 0.1 OUTLIER 38.72 -160.02 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.571 -0.706 . . . . 0.0 110.624 179.696 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.6 112.75 15.87 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.198 -0.939 . . . . 0.0 110.187 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 15.4 mtm180 -64.72 -45.04 88.23 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.318 -0.864 . . . . 0.0 110.225 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 49.01 84.52 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.27 -0.894 . . . . 0.0 110.177 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -119.56 29.74 7.45 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 0.0 110.194 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 4.8 mtt-85 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.232 -179.941 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -3' ' ' GLY . . . . . 0.415 ' C ' ' OG ' ' A' ' -2' ' ' SER . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -2' ' ' SER . . . . . 0.415 ' OG ' ' C ' ' A' ' -3' ' ' GLY . 0.8 OUTLIER -162.24 130.86 4.17 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.231 -1.158 . . . . 0.0 110.159 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 52.9 m -109.38 39.83 1.99 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.0 110.253 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -112.43 -50.23 2.91 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.316 -0.865 . . . . 0.0 110.206 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.1 ptp -129.05 -30.89 2.17 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.272 -0.893 . . . . 0.0 110.326 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 50.66 86.21 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.142 -0.974 . . . . 0.0 110.112 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -132.08 163.6 28.11 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.31 -0.868 . . . . 0.0 110.191 179.936 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.418 ' C ' ' O ' ' A' ' 3' ' ' THR . 1.2 m -43.3 112.21 0.35 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.194 -0.941 . . . . 0.0 110.143 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.551 ' O ' HD12 ' A' ' 6' ' ' LEU . 2.2 p -97.31 -67.63 0.84 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.235 -0.916 . . . . 0.0 110.279 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.551 HD12 ' O ' ' A' ' 5' ' ' SER . 0.2 OUTLIER -166.8 120.46 1.03 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.282 -0.887 . . . . 0.0 110.284 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -59.31 173.87 0.46 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.259 -0.901 . . . . 0.0 110.243 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.7 174.06 10.69 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.2 -0.937 . . . . 0.0 110.177 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -96.27 71.94 2.81 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.256 -0.902 . . . . 0.0 110.22 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 30.5 mtp -96.15 -82.37 0.39 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 110.165 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -71.13 -40.98 71.07 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.228 -0.92 . . . . 0.0 110.123 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.472 ' OD1' ' NE2' ' A' ' 15' ' ' HIS . 49.6 t-20 -89.18 116.16 27.22 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.27 -0.894 . . . . 0.0 110.133 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.47 HG22 HG22 ' A' ' 14' ' ' VAL . 35.6 mm -110.03 -76.35 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.244 -0.91 . . . . 0.0 110.28 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.47 HG22 HG22 ' A' ' 13' ' ' ILE . 3.2 m -136.46 116.63 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.216 -0.928 . . . . 0.0 110.391 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.472 ' NE2' ' OD1' ' A' ' 12' ' ' ASN . 14.1 m170 -103.81 -61.84 1.38 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.309 -0.869 . . . . 0.0 110.165 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -172.57 89.03 0.09 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.294 -0.879 . . . . 0.0 110.231 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -92.54 167.52 11.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.184 -0.948 . . . . 0.0 110.236 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.4 ' HB2' ' CD2' ' A' ' 46' ' ' LEU . 59.7 p -139.27 -47.06 0.47 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.333 -0.854 . . . . 0.0 110.103 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 50.61 42.94 27.59 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.24 -0.912 . . . . 0.0 110.286 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.559 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -72.46 -42.35 65.07 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.186 -0.946 . . . . 0.0 110.265 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.476 ' HG3' HG12 ' A' ' 22' ' ' ILE . 17.2 pt-20 -43.23 -34.41 1.15 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.257 -0.902 . . . . 0.0 110.01 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.476 HG12 ' HG3' ' A' ' 21' ' ' GLU . 25.0 mm -79.83 -50.24 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.383 -0.823 . . . . 0.0 109.811 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.776 ' O ' HD11 ' A' ' 43' ' ' ILE . 4.1 mptt -48.76 -27.99 3.33 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.281 -0.887 . . . . 0.0 110.096 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.757 HG21 ' HA ' ' A' ' 56' ' ' ILE . 91.6 t -85.42 -33.62 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.263 -0.898 . . . . 0.0 110.014 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -62.87 -43.27 99.24 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.249 -0.907 . . . . 0.0 109.921 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -33.31 61.76 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.484 -0.76 . . . . 0.0 110.061 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.629 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -64.57 -23.17 67.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.333 -0.854 . . . . 0.0 110.13 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.476 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 40.7 p -130.05 75.87 1.68 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.241 -0.912 . . . . 0.0 110.223 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 29.6 t -175.45 -74.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.159 -0.963 . . . . 0.0 110.149 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -127.62 96.03 4.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.463 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 5.5 p-10 -52.52 134.38 44.24 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.934 . . . . 0.0 110.117 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 31' ' ' ASP . 24.4 Cg_exo -58.33 -179.47 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 123.964 1.507 . . . . 0.0 110.306 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.423 ' O ' ' C ' ' A' ' 34' ' ' GLY . 1.7 m95 -60.46 -164.31 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.292 -0.88 . . . . 0.0 110.39 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 33' ' ' TRP . . . 43.15 -148.01 0.74 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -68.56 -178.57 1.94 Allowed 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.938 1.493 . . . . 0.0 110.328 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.3 m -116.53 47.26 1.46 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.284 -0.885 . . . . 0.0 110.215 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.2 m -125.84 81.9 2.02 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.905 . . . . 0.0 110.187 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.408 ' O ' ' N ' ' A' ' 40' ' ' MET . 0.7 OUTLIER -158.42 -172.7 3.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.23 -0.919 . . . . 0.0 110.227 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.885 ' O ' HD12 ' A' ' 43' ' ' ILE . 4.5 tp 46.68 20.11 0.1 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.278 -0.889 . . . . 0.0 110.712 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.408 ' N ' ' O ' ' A' ' 38' ' ' SER . 2.9 mtt -96.71 -43.7 7.43 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.186 -0.946 . . . . 0.0 109.869 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.0 t -67.33 -28.8 68.28 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.334 -0.854 . . . . 0.0 110.374 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.46 ' O ' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -73.4 -50.37 22.17 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.25 -0.906 . . . . 0.0 110.359 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.935 HG21 HD11 ' A' ' 80' ' ' LEU . 20.9 mt -56.34 -36.62 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.234 -0.916 . . . . 0.0 110.272 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.751 ' CB ' HG23 ' A' ' 87' ' ' THR . . . -70.05 -48.49 57.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.064 -1.023 . . . . 0.0 109.486 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.462 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -53.49 -20.68 5.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.047 -1.033 . . . . 0.0 108.995 178.856 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.741 ' HB3' HD11 ' A' ' 56' ' ' ILE . 15.6 mt -81.5 -36.91 28.69 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.499 -0.751 . . . . 0.0 109.884 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.516 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 67.9 p -51.92 -43.42 63.41 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.269 -0.972 . . . . 0.0 109.038 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 93.4 m-85 -45.02 -43.3 9.11 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.433 -0.907 . . . . 0.0 109.399 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 50' ' ' VAL . 0.8 OUTLIER -71.78 90.47 1.09 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.551 -0.718 . . . . 0.0 110.51 179.631 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.02 -58.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.609 178.175 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.544 HG12 ' N ' ' A' ' 52' ' ' ALA . 3.0 t -66.11 -66.26 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.052 -1.03 . . . . 0.0 110.345 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.62 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -35.46 -42.9 0.23 Allowed 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.16 0.505 . . . . 0.0 110.833 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.593 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 32.0 t80 -58.91 -55.16 38.69 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.413 -0.804 . . . . 0.0 110.21 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.7 t -53.92 -28.18 35.34 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.316 -0.865 . . . . 0.0 109.924 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.38 -30.37 37.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.297 -0.877 . . . . 0.0 109.997 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.757 ' HA ' HG21 ' A' ' 24' ' ' VAL . 6.7 mt -75.89 -65.8 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.398 -0.814 . . . . 0.0 109.963 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.593 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 89.4 mmm -45.94 -34.49 3.97 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.21 -0.931 . . . . 0.0 109.792 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.6 m -57.7 -63.99 1.05 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.333 -0.854 . . . . 0.0 110.108 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.471 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.4 OUTLIER -57.93 -20.21 35.78 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.946 . . . . 0.0 110.104 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.786 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -79.67 -30.6 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.337 -0.852 . . . . 0.0 109.979 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.56 ' CD1' ' O ' ' A' ' 57' ' ' MET . 21.6 m95 -80.94 -44.74 17.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.162 -0.962 . . . . 0.0 110.162 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.73 -44.37 85.95 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.289 -0.882 . . . . 0.0 109.813 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -73.75 -14.42 61.12 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.0 109.942 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.921 HD22 HD11 ' A' ' 106' ' ' LEU . 10.1 mt -85.0 -19.49 31.94 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.304 -0.872 . . . . 0.0 110.312 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -99.14 34.75 2.06 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.247 -0.908 . . . . 0.0 110.141 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.682 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.2 OUTLIER -73.13 -167.66 0.42 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.377 -0.827 . . . . 0.0 110.225 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.573 ' HA ' ' CZ ' ' A' ' 109' ' ' PHE . 4.4 p80 -178.64 172.02 1.45 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.183 -0.948 . . . . 0.0 110.274 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.81 -125.5 7.34 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -117.34 -3.61 11.42 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.288 -1.125 . . . . 0.0 110.114 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -87.18 24.17 1.64 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.283 -0.885 . . . . 0.0 110.241 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.551 ' CZ3' ' HA ' ' A' ' 72' ' ' ARG . 21.7 p-90 -52.3 -19.53 2.14 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.251 -0.906 . . . . 0.0 110.12 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.551 ' HA ' ' CZ3' ' A' ' 71' ' ' TRP . 11.8 ptm180 -42.83 -33.18 0.72 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.309 -0.87 . . . . 0.0 110.138 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.425 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 1.3 m-70 -68.28 -48.58 64.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.197 -0.939 . . . . 0.0 109.961 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.682 HG23 ' HB2' ' A' ' 66' ' ' ASP . 79.5 t -53.53 -50.78 47.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 0.0 109.978 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.629 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 2.8 t80 -50.42 -58.97 4.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.215 -0.928 . . . . 0.0 109.979 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.476 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 4.9 mttt -56.62 -25.3 52.72 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.363 -0.836 . . . . 0.0 110.09 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.794 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -73.85 -34.19 64.4 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.89 . . . . 0.0 110.207 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.718 ' HE1' HG13 ' A' ' 123' ' ' VAL . 0.4 OUTLIER -65.59 -34.73 78.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.346 -0.846 . . . . 0.0 110.029 179.841 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 44.5 m -67.99 -59.68 3.08 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 110.317 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.935 HD11 HG21 ' A' ' 43' ' ' ILE . 25.6 tp -47.51 -55.1 9.82 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.31 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' MET . . . . . 1.051 ' HG2' HD21 ' A' ' 130' ' ' LEU . 2.0 tpt -51.3 -35.57 38.4 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.113 -0.992 . . . . 0.0 110.29 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.753 ' HA ' HD12 ' A' ' 85' ' ' ILE . 26.4 tt0 -71.31 -64.86 0.83 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.183 -0.948 . . . . 0.0 110.418 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 1.098 ' CE1' HG21 ' A' ' 87' ' ' THR . 45.3 t80 -43.8 -38.05 3.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.207 -0.933 . . . . 0.0 110.955 -179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.687 HD23 ' HB2' ' A' ' 44' ' ' ALA . 68.8 mt -76.81 -34.36 57.94 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.124 -0.985 . . . . 0.0 110.751 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.016 HD13 HD21 ' A' ' 134' ' ' LEU . 10.6 mt -50.89 -21.2 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.924 -1.11 . . . . 0.0 109.722 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.69 -77.45 0.57 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.232 -0.917 . . . . 0.0 110.156 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' THR . . . . . 1.098 HG21 ' CE1' ' A' ' 83' ' ' TYR . 13.0 t -61.85 -13.92 28.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.251 -0.906 . . . . 0.0 110.147 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.668 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -88.82 30.9 5.19 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.495 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 71.47 157.15 0.17 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.318 -1.107 . . . . 0.0 110.431 179.961 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -66.95 -7.19 20.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.424 -0.798 . . . . 0.0 110.485 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -73.09 -40.38 65.05 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 0.0 109.714 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.685 HG11 ' CB ' ' A' ' 84' ' ' LEU . 86.8 t -61.09 -35.15 63.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.315 -0.866 . . . . 0.0 109.855 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.4 t -75.51 -43.84 46.87 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.156 -0.965 . . . . 0.0 109.678 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -56.79 -37.5 71.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.0 109.603 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -65.22 -41.51 94.37 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.348 -0.845 . . . . 0.0 109.288 179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.427 ' SG ' ' HE2' ' A' ' 81' ' ' MET . 4.6 t -54.22 -42.21 69.55 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.333 -0.854 . . . . 0.0 109.236 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.469 ' CE ' ' HB2' ' A' ' 135' ' ' ARG . 0.6 OUTLIER -65.59 -34.17 77.6 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.505 -0.747 . . . . 0.0 109.351 179.283 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -78.77 -13.68 59.68 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.532 -0.73 . . . . 0.0 109.702 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -134.51 35.52 3.18 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.461 -0.774 . . . . 0.0 110.017 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.8 mtm -63.04 -28.44 70.1 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.245 -0.91 . . . . 0.0 110.133 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.47 ' O ' ' HB ' ' A' ' 105' ' ' THR . 44.0 m-85 -63.04 -22.66 67.01 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -0.89 . . . . 0.0 109.935 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.953 ' O ' HG22 ' A' ' 105' ' ' THR . . . -77.56 -41.12 40.07 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.309 -0.869 . . . . 0.0 110.069 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.498 HG13 HD23 ' A' ' 130' ' ' LEU . 3.4 t -74.75 -26.46 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.392 -0.817 . . . . 0.0 109.967 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.485 ' OE1' HG21 ' A' ' 131' ' ' VAL . 17.4 mm100 -85.64 -25.96 26.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.303 -0.873 . . . . 0.0 110.153 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.953 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.5 t -62.19 -23.88 66.87 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.241 -0.912 . . . . 0.0 110.154 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.921 HD11 HD22 ' A' ' 64' ' ' LEU . 13.5 mt -65.03 -40.51 94.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.186 -0.946 . . . . 0.0 110.177 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.409 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 13.7 ttpp -53.34 -29.63 35.02 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.181 -0.949 . . . . 0.0 109.884 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.454 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 1.3 m-20 -84.67 -26.71 27.58 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.351 -0.843 . . . . 0.0 110.015 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.573 ' CZ ' ' HA ' ' A' ' 67' ' ' HIS . 1.2 t80 -61.31 96.73 0.06 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.334 -0.854 . . . . 0.0 110.088 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 20.1 mt-30 -128.6 102.87 6.79 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.292 -0.88 . . . . 0.0 110.315 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -146.02 118.69 8.59 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.264 -0.897 . . . . 0.0 110.087 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.693 ' O ' HG12 ' A' ' 112' ' ' VAL . 92.3 t -122.43 23.37 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -0.921 . . . . 0.0 110.285 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.429 ' O ' ' O ' ' A' ' 112' ' ' VAL . 0.8 OUTLIER 52.4 174.76 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.295 -0.878 . . . . 0.0 110.282 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.32 -49.07 70.57 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.213 -0.929 . . . . 0.0 110.461 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.459 ' O ' ' OD1' ' A' ' 115' ' ' ASP . 32.5 p30 -129.94 64.63 1.51 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.083 -1.011 . . . . 0.0 110.541 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -80.14 -153.46 8.7 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.474 ' O ' ' HG2' ' A' ' 119' ' ' GLN . 8.3 tttt -109.05 39.12 2.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.153 -1.204 . . . . 0.0 110.21 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.442 ' C ' ' O ' ' A' ' 117' ' ' LYS . 15.4 t0 39.55 39.58 0.52 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.456 -0.778 . . . . 0.0 110.763 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 117' ' ' LYS . 12.2 mm100 -93.45 -97.72 0.14 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.194 -0.941 . . . . 0.0 110.04 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.437 ' C ' ' O ' ' A' ' 119' ' ' GLN . . . 42.15 27.16 0.4 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.857 -1.297 . . . . 0.0 109.857 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.814 HG22 ' OE1' ' A' ' 125' ' ' GLU . 4.2 p -127.18 -44.48 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 O-C-N 121.091 -1.24 . . . . 0.0 110.376 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.577 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 1.7 m120 -46.26 -31.41 2.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.213 -0.929 . . . . 0.0 110.258 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.718 HG13 ' HE1' ' A' ' 78' ' ' MET . 2.0 t -83.13 -55.2 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.25 -0.906 . . . . 0.0 110.361 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.42 ' N ' HG12 ' A' ' 123' ' ' VAL . 2.2 tmt_? -47.74 -49.78 27.32 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.009 -1.057 . . . . 0.0 111.073 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.814 ' OE1' HG22 ' A' ' 121' ' ' VAL . 21.4 mt-10 -64.85 -53.22 50.2 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.257 -0.902 . . . . 0.0 111.505 -179.164 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.629 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -50.13 -45.43 52.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.982 -1.074 . . . . 0.0 110.682 -179.242 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.24 -42.93 83.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.22 -0.925 . . . . 0.0 110.396 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -45.9 -55.99 6.01 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.184 -0.948 . . . . 0.0 110.276 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -58.56 -51.1 71.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 0.0 110.333 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 1.051 HD21 ' HG2' ' A' ' 81' ' ' MET . 25.6 tp -46.09 -27.78 1.04 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.246 -0.909 . . . . 0.0 110.316 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.485 HG21 ' OE1' ' A' ' 104' ' ' GLN . 25.6 t -89.87 -33.87 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.208 -0.933 . . . . 0.0 110.284 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.82 -58.26 6.04 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.23 -0.919 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.6 tt -51.63 -39.5 58.2 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.22 -0.925 . . . . 0.0 110.241 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 1.02 HD23 ' O ' ' A' ' 130' ' ' LEU . 2.9 mm? -54.37 -55.56 27.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 110.182 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.469 ' HB2' ' CE ' ' A' ' 97' ' ' LYS . 29.2 ttt-85 -139.79 82.32 1.87 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.228 -0.92 . . . . 0.0 110.196 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.25 -75.05 0.47 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.281 -0.887 . . . . 0.0 110.307 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -55.73 178.35 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.262 -0.899 . . . . 0.0 110.327 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -129.38 71.46 1.44 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.242 -0.911 . . . . 0.0 110.193 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -69.36 -160.06 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.219 -0.925 . . . . 0.0 110.297 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.531 ' O ' HD12 ' A' ' 140' ' ' LEU . 1.4 pp -102.07 24.17 10.49 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.151 -0.968 . . . . 0.0 110.221 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.55 104.25 0.09 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.134 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.61 177.24 6.4 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.944 . . . . 0.0 110.37 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.71 164.93 0.07 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.286 -0.884 . . . . 0.0 110.277 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 51.3 ttt180 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.144 179.952 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.28 -69.31 0.74 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.239 -1.154 . . . . 0.0 110.18 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 2.2 t -112.34 79.5 1.23 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.258 -0.901 . . . . 0.0 110.159 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 0' ' ' ARG . . . . . 0.442 ' O ' ' CB ' ' A' ' 1' ' ' MET . 3.4 ttt180 -171.81 133.42 0.75 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.206 -0.934 . . . . 0.0 110.3 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.442 ' CB ' ' O ' ' A' ' 0' ' ' ARG . 0.0 OUTLIER 64.62 9.99 5.57 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.196 -0.94 . . . . 0.0 110.235 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -131.47 40.27 3.43 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.296 -0.877 . . . . 0.0 110.19 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 58.4 m -97.34 83.88 3.37 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.33 -0.857 . . . . 0.0 110.261 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.8 p -51.09 167.51 0.08 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.199 -0.938 . . . . 0.0 110.191 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.0 m -135.82 167.39 21.26 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.231 -0.918 . . . . 0.0 110.156 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.73 117.49 34.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.249 -0.907 . . . . 0.0 110.197 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -122.14 132.54 54.52 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.246 -0.909 . . . . 0.0 110.222 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -164.92 141.15 5.73 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.251 -0.905 . . . . 0.0 110.214 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.37 25.19 2.66 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -0.921 . . . . 0.0 110.241 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 60.1 mtt -117.77 152.91 34.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.301 -0.874 . . . . 0.0 110.229 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -92.87 -77.26 0.45 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.241 -0.912 . . . . 0.0 110.186 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.401 ' C ' HG13 ' A' ' 13' ' ' ILE . 0.5 OUTLIER -179.85 50.16 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.276 -0.89 . . . . 0.0 110.164 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.956 HG22 HG23 ' A' ' 14' ' ' VAL . 4.7 mt -124.32 141.42 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.291 -0.88 . . . . 0.0 110.219 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.956 HG23 HG22 ' A' ' 13' ' ' ILE . 4.6 t 41.89 82.12 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.38 -0.825 . . . . 0.0 110.289 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 5.1 t-160 -113.53 67.15 0.67 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.242 -0.912 . . . . 0.0 110.142 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.408 ' OD1' ' C ' ' A' ' 16' ' ' ASN . 35.3 p30 -108.4 178.66 4.43 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.297 -0.877 . . . . 0.0 110.186 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.451 ' O ' ' HB2' ' A' ' 18' ' ' SER . 74.1 m-85 -67.68 124.13 22.43 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.297 -0.877 . . . . 0.0 110.246 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 17' ' ' TYR . 43.5 t -179.2 37.82 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.306 -0.871 . . . . 0.0 110.177 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -108.22 2.06 22.52 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.245 -0.909 . . . . 0.0 110.305 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.76 ' HA ' HD13 ' A' ' 46' ' ' LEU . . . -64.67 -44.52 90.1 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.266 -0.896 . . . . 0.0 110.178 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.402 ' HG3' HG12 ' A' ' 22' ' ' ILE . 11.1 pt-20 -55.52 -42.87 75.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.177 -0.952 . . . . 0.0 110.292 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.402 HG12 ' HG3' ' A' ' 21' ' ' GLU . 25.1 mm -63.68 -53.87 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.288 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HB3' HG13 ' A' ' 43' ' ' ILE . 28.7 mmtm -50.74 -58.97 4.62 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.207 -0.933 . . . . 0.0 110.349 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.91 HG21 ' HA ' ' A' ' 56' ' ' ILE . 38.2 t -45.0 -44.52 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.0 110.447 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -38.64 91.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.118 -0.989 . . . . 0.0 110.334 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -72.03 -20.66 61.66 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.322 -0.861 . . . . 0.0 110.055 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.758 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -86.81 -15.94 37.7 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.198 -0.939 . . . . 0.0 110.05 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.505 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 14.0 p -112.1 44.29 1.44 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.33 -0.856 . . . . 0.0 110.102 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 m -169.38 -165.42 0.52 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.286 -0.884 . . . . 0.0 110.171 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -149.57 57.51 0.99 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.278 -0.888 . . . . 0.0 110.23 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.568 ' N ' ' HD2' ' A' ' 32' ' ' PRO . 0.3 OUTLIER -62.8 -50.27 78.36 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.256 -0.903 . . . . 0.0 110.589 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 31' ' ' ASP . 35.8 Cg_endo -73.58 170.91 18.87 Favored 'Trans proline' 0 C--N 1.309 -1.53 0 O-C-N 123.727 1.383 . . . . 0.0 110.423 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -60.27 -87.06 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.225 -0.922 . . . . 0.0 110.707 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.88 -164.12 6.61 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -62.87 -170.38 0.1 OUTLIER 'Trans proline' 0 C--N 1.305 -1.755 0 O-C-N 124.053 1.554 . . . . 0.0 110.339 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.7 m -95.02 161.97 13.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.202 -0.936 . . . . 0.0 110.19 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.2 m -93.41 86.41 5.26 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.268 -0.895 . . . . 0.0 110.229 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.14 77.89 0.27 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.159 -0.963 . . . . 0.0 110.159 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.758 HD23 ' HB2' ' A' ' 27' ' ' ALA . 1.6 tp -118.26 -33.16 4.46 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.28 -0.888 . . . . 0.0 110.209 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -60.68 3.41 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.221 -0.925 . . . . 0.0 110.264 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.564 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 14.1 m -46.87 -28.29 1.53 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.202 -0.936 . . . . 0.0 110.216 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HB3' ' O ' ' A' ' 39' ' ' LEU . 19.5 tp10 -71.92 -50.74 26.51 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.305 -0.872 . . . . 0.0 110.249 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.596 HG21 HD11 ' A' ' 80' ' ' LEU . 8.1 mt -54.91 -31.46 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.137 -0.977 . . . . 0.0 110.03 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.537 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.48 -53.4 16.42 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.248 -0.908 . . . . 0.0 109.547 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.523 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER -53.15 -20.88 4.28 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.02 -1.05 . . . . 0.0 109.044 179.112 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.809 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 11.0 mt -80.66 -37.16 31.4 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.522 -0.736 . . . . 0.0 110.108 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.63 HG21 HG21 ' A' ' 92' ' ' VAL . 68.8 p -53.54 -43.14 68.17 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.031 -1.043 . . . . 0.0 109.29 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.523 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 92.6 m-85 -43.57 -41.23 4.43 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.394 -0.816 . . . . 0.0 109.523 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.536 ' O ' ' N ' ' A' ' 51' ' ' VAL . 0.5 OUTLIER -74.69 93.1 2.51 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.427 -0.796 . . . . 0.0 110.247 179.459 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.532 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.42 -57.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.535 178.262 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.541 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.8 t -64.48 -65.69 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.018 -1.051 . . . . 0.0 110.359 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.809 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.84 -48.87 1.16 Allowed 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.051 -177.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.573 ' HA ' HD12 ' A' ' 56' ' ' ILE . 2.6 t80 -55.15 -53.32 57.46 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.198 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 58' ' ' SER . 1.1 t -57.41 -26.31 60.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.179 -0.951 . . . . 0.0 110.416 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -87.58 -20.45 26.4 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.171 -0.955 . . . . 0.0 110.492 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.91 ' HA ' HG21 ' A' ' 24' ' ' VAL . 10.8 mt -78.99 -70.09 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.192 -0.942 . . . . 0.0 110.316 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.511 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 9.6 mtp -50.92 -36.79 40.24 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.174 -0.954 . . . . 0.0 109.897 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.482 ' HB2' ' O ' ' A' ' 54' ' ' SER . 42.3 t -54.37 -59.99 3.95 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.274 -0.891 . . . . 0.0 109.761 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.42 ' HA ' ' HD3' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -58.83 -28.9 66.48 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.336 -0.852 . . . . 0.0 109.587 179.488 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.768 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -66.99 -31.65 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.458 -0.776 . . . . 0.0 109.624 179.699 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.55 ' CH2' ' HE3' ' A' ' 81' ' ' MET . 41.6 m95 -76.04 -47.41 24.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.183 -0.948 . . . . 0.0 110.191 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.42 ' HD3' ' HA ' ' A' ' 59' ' ' MET . 5.9 mttt -49.86 -61.9 1.87 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.347 -0.845 . . . . 0.0 110.393 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.455 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 20.4 mmt-85 -64.27 -19.84 65.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.244 -0.91 . . . . 0.0 110.19 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.994 ' CD2' HD11 ' A' ' 106' ' ' LEU . 3.2 mt -70.73 -20.41 62.64 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.169 -0.957 . . . . 0.0 110.332 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -106.63 38.02 2.17 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.188 -0.945 . . . . 0.0 110.218 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.601 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.7 OUTLIER -61.0 140.6 57.79 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.293 -0.879 . . . . 0.0 110.14 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 54.8 m80 -124.32 -179.82 4.61 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.457 -0.777 . . . . 0.0 110.191 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 70.32 -105.47 1.59 Allowed Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.444 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 2.3 ttpt -140.59 72.27 1.39 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.239 -1.153 . . . . 0.0 110.149 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.402 ' HB3' ' OD2' ' A' ' 66' ' ' ASP . 0.5 OUTLIER -151.43 29.61 0.62 Allowed 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.381 -0.825 . . . . 0.0 110.287 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.577 ' CZ3' ' HG3' ' A' ' 72' ' ' ARG . 46.1 p-90 -54.47 -17.72 3.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.242 -0.912 . . . . 0.0 110.308 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.577 ' HG3' ' CZ3' ' A' ' 71' ' ' TRP . 0.9 OUTLIER -53.75 -42.01 67.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.208 -0.933 . . . . 0.0 110.232 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -66.05 -39.81 90.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.2 -0.938 . . . . 0.0 110.244 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.73 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 9.6 t -55.49 -57.12 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.178 -0.951 . . . . 0.0 110.175 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.625 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 17.3 t80 -48.77 -66.77 0.34 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -0.924 . . . . 0.0 110.019 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.505 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.3 OUTLIER -49.22 -25.29 2.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.366 -0.834 . . . . 0.0 109.963 179.851 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.826 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -67.75 -50.71 55.82 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.278 -0.889 . . . . 0.0 110.172 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.758 ' SD ' HD21 ' A' ' 64' ' ' LEU . 3.2 mpp? -54.91 -29.79 56.83 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.358 -0.839 . . . . 0.0 110.198 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.402 ' O ' ' HB3' ' A' ' 82' ' ' GLU . 2.6 m -67.59 -53.88 24.47 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.355 -0.841 . . . . 0.0 110.527 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.768 ' CD2' HD11 ' A' ' 60' ' ' ILE . 21.0 tp -55.84 -53.33 58.04 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.224 -0.922 . . . . 0.0 110.106 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.776 ' SD ' HD21 ' A' ' 130' ' ' LEU . 0.4 OUTLIER -55.0 -24.99 26.95 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.095 -1.003 . . . . 0.0 110.446 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.687 ' HB2' HD12 ' A' ' 130' ' ' LEU . 2.8 tt0 -79.37 -59.44 2.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.066 -1.021 . . . . 0.0 110.436 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.586 ' CE1' HG21 ' A' ' 87' ' ' THR . 17.8 t80 -53.45 -31.35 45.11 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.423 -0.798 . . . . 0.0 111.013 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.823 ' CB ' HG11 ' A' ' 92' ' ' VAL . 73.9 mt -77.87 -29.98 50.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 0.0 110.638 -179.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.878 HD13 HD11 ' A' ' 134' ' ' LEU . 26.5 mt -64.09 -11.59 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.087 -1.008 . . . . 0.0 109.974 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -107.43 -72.35 0.72 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.27 -0.894 . . . . 0.0 110.168 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.586 HG21 ' CE1' ' A' ' 83' ' ' TYR . 12.2 t -89.16 1.3 55.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.15 -0.969 . . . . 0.0 110.189 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.613 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -91.35 28.1 8.62 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.5 OUTLIER 75.06 149.29 0.1 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.562 -0.964 . . . . 0.0 110.114 -179.822 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.74 -10.3 12.33 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.391 -0.818 . . . . 0.0 110.635 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 73.8 mtp85 -70.32 -45.82 65.46 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.059 -1.026 . . . . 0.0 109.647 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.823 HG11 ' CB ' ' A' ' 84' ' ' LEU . 96.9 t -52.56 -30.94 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 O-C-N 121.488 -0.758 . . . . 0.0 110.039 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.548 ' OG ' HD21 ' A' ' 134' ' ' LEU . 21.0 t -81.23 -37.39 28.66 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.323 -0.861 . . . . 0.0 109.884 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.409 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 24.4 mm-40 -56.61 -52.55 64.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -0.873 . . . . 0.0 109.927 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.443 ' HB3' ' SD ' ' A' ' 57' ' ' MET . 7.0 tp60 -57.26 -36.95 71.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.465 -0.772 . . . . 0.0 109.594 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.6 t -57.22 -39.64 75.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.272 -0.892 . . . . 0.0 109.651 179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -71.79 -30.3 65.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.497 -0.752 . . . . 0.0 109.66 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 61.9 mt-10 -83.94 -11.83 56.27 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.453 -0.779 . . . . 0.0 110.029 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -128.41 32.08 4.91 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.375 -0.828 . . . . 0.0 110.133 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.4 ppp? -63.9 -20.44 65.85 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.263 -0.898 . . . . 0.0 110.118 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.484 ' O ' ' HB ' ' A' ' 105' ' ' THR . 31.6 m-85 -75.97 -20.85 57.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.277 -0.889 . . . . 0.0 110.274 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.951 ' O ' HG22 ' A' ' 105' ' ' THR . . . -85.72 -39.85 16.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.155 -0.966 . . . . 0.0 110.106 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.618 HG11 HG22 ' A' ' 131' ' ' VAL . 3.6 p -73.93 -41.91 53.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.637 0 CA-C-O 122.033 0.92 . . . . 0.0 109.141 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.568 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 3.7 mm-40 -69.42 -24.51 63.85 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.68 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 102' ' ' ALA . 5.0 t -59.53 -27.77 66.48 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.953 -1.092 . . . . 0.0 109.932 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.994 HD11 ' CD2' ' A' ' 64' ' ' LEU . 61.8 mt -59.44 -37.74 78.89 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.324 -0.86 . . . . 0.0 110.144 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.413 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 34.8 ttpt -45.93 -32.41 2.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.021 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -94.94 -27.19 15.8 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.381 -0.825 . . . . 0.0 110.075 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.476 ' CZ ' ' O ' ' A' ' 66' ' ' ASP . 3.0 t80 -44.64 118.12 1.49 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.316 -0.865 . . . . 0.0 110.24 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -156.57 165.09 37.27 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.313 -0.867 . . . . 0.0 110.156 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -165.95 114.86 0.97 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.251 -0.906 . . . . 0.0 110.286 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.683 HG13 ' N ' ' A' ' 117' ' ' LYS . 19.3 t -140.85 78.23 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.206 -0.933 . . . . 0.0 110.339 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -110.06 -89.91 0.48 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 110.085 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.7 ptt-85 -52.11 -48.31 64.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.287 -0.883 . . . . 0.0 110.254 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -63.07 -82.03 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.313 -0.867 . . . . 0.0 110.129 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.444 ' C ' ' CG1' ' A' ' 112' ' ' VAL . . . 123.3 10.51 5.54 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.683 ' N ' HG13 ' A' ' 112' ' ' VAL . 0.4 OUTLIER -133.63 144.83 49.49 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.267 -1.137 . . . . 0.0 110.201 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -45.42 130.74 8.51 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.273 -0.892 . . . . 0.0 110.164 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -44.15 -77.55 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.23 -0.919 . . . . 0.0 110.252 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -161.26 151.86 22.28 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.54 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.0 p -93.28 -41.09 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.347 -1.09 . . . . 0.0 110.149 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.54 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 15.3 m-20 -36.36 -29.1 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.877 -0.514 . . . . 0.0 111.022 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.606 HG13 ' CG1' ' A' ' 74' ' ' VAL . 12.0 t -73.72 -64.72 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.122 -0.986 . . . . 0.0 110.358 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.413 ' HG3' ' HA ' ' A' ' 107' ' ' LYS . 35.5 ttp180 -51.96 -31.25 28.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.256 -0.902 . . . . 0.0 110.77 -179.525 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.467 ' HG3' HG22 ' A' ' 121' ' ' VAL . 11.5 mt-10 -76.31 -46.98 25.25 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.173 -0.955 . . . . 0.0 110.617 -179.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.625 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -55.43 -49.71 71.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.99 . . . . 0.0 110.257 -179.763 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.564 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -66.33 -41.31 89.78 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.305 -0.872 . . . . 0.0 110.712 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -34.25 73.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.178 -0.951 . . . . 0.0 110.762 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -77.67 -28.54 51.17 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.183 -0.948 . . . . 0.0 110.861 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.776 HD21 ' SD ' ' A' ' 81' ' ' MET . 5.1 tt -68.74 -48.0 64.89 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.134 -0.979 . . . . 0.0 110.282 -179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.618 HG22 HG11 ' A' ' 103' ' ' VAL . 5.3 t -69.4 -28.18 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.261 -0.899 . . . . 0.0 110.137 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.48 -47.12 57.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.852 . . . . 0.0 110.432 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.98 -33.56 70.82 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.18 -0.95 . . . . 0.0 110.4 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.878 HD11 HD13 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -73.24 -65.36 0.82 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.168 -0.958 . . . . 0.0 110.425 -179.929 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -92.03 40.05 1.03 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.202 -0.936 . . . . 0.0 110.305 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.416 ' O ' ' O ' ' A' ' 137' ' ' GLU . 10.6 t0 -62.15 -19.15 62.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.244 -0.91 . . . . 0.0 110.161 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.416 ' O ' ' O ' ' A' ' 136' ' ' ASP . 0.4 OUTLIER -56.93 -164.09 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.167 -0.958 . . . . 0.0 110.048 179.94 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 55.48 95.27 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.152 -0.968 . . . . 0.0 110.244 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -55.13 156.76 3.81 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.209 -0.932 . . . . 0.0 110.296 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.12 133.25 42.67 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.121 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 7.5 mtt-85 -53.76 158.11 2.08 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.24 -0.913 . . . . 0.0 110.211 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -169.53 144.85 3.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.193 -0.942 . . . . 0.0 110.263 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -138.69 144.45 39.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.304 -0.872 . . . . 0.0 110.135 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 25.9 ttt180 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.171 179.949 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.382 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -2' ' ' SER . . . . . 0.425 ' O ' ' CB ' ' A' ' -1' ' ' SER . 19.7 m -146.6 89.57 1.85 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.286 -1.126 . . . . 0.0 110.252 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' -1' ' ' SER . . . . . 0.425 ' CB ' ' O ' ' A' ' -2' ' ' SER . 0.9 OUTLIER 64.4 -161.45 0.28 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.241 -0.912 . . . . 0.0 110.236 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -144.64 137.84 26.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.249 -0.907 . . . . 0.0 110.269 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 ttp -95.72 162.8 13.45 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.186 -0.946 . . . . 0.0 110.132 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -136.18 172.24 13.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.237 -0.914 . . . . 0.0 110.226 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.77 161.56 37.77 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.242 -0.912 . . . . 0.0 110.306 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.6 -172.81 2.16 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.247 -0.908 . . . . 0.0 110.251 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.42 -143.3 0.23 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.269 -0.894 . . . . 0.0 110.228 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.2 tp -142.52 -72.03 0.32 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.258 -0.901 . . . . 0.0 110.203 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -135.72 171.14 14.89 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.217 -0.927 . . . . 0.0 110.238 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.3 mtm-85 -47.39 -67.97 0.23 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.26 -0.9 . . . . 0.0 110.259 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -135.31 179.73 6.15 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.2 -0.938 . . . . 0.0 110.226 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.2 mtt -124.34 -165.54 1.38 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -0.942 . . . . 0.0 110.025 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -44.57 158.14 0.06 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.191 -0.943 . . . . 0.0 110.016 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.458 ' O ' ' HB ' ' A' ' 13' ' ' ILE . 27.4 t30 -155.77 -37.95 0.08 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.23 -0.918 . . . . 0.0 110.308 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.458 ' HB ' ' O ' ' A' ' 12' ' ' ASN . 2.0 mt 60.07 124.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.288 -0.882 . . . . 0.0 110.251 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.443 ' O ' HG13 ' A' ' 14' ' ' VAL . 5.2 p -101.49 133.25 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.201 -0.937 . . . . 0.0 110.394 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -145.76 28.39 1.16 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.341 -0.849 . . . . 0.0 110.096 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -84.81 -141.27 0.08 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.265 -0.897 . . . . 0.0 110.345 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.479 ' O ' ' CB ' ' A' ' 18' ' ' SER . 43.6 p90 -77.05 140.86 40.44 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.286 -0.884 . . . . 0.0 110.368 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.479 ' CB ' ' O ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER 169.81 52.1 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.298 -0.876 . . . . 0.0 109.958 179.879 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.429 ' O ' ' HB ' ' A' ' 22' ' ' ILE . 50.7 mt-10 -103.49 7.86 37.85 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.173 -0.954 . . . . 0.0 110.491 -179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.785 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -56.86 -54.59 44.71 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.156 -0.965 . . . . 0.0 110.129 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' A' ' 20' ' ' ALA . 5.7 pt-20 -43.75 -26.49 0.25 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.095 -1.003 . . . . 0.0 109.975 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 19' ' ' GLU . 21.5 mm -77.72 -49.01 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.293 -0.879 . . . . 0.0 110.074 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.67 -42.94 75.83 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.296 -0.878 . . . . 0.0 110.138 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.717 HG13 ' CD2' ' A' ' 80' ' ' LEU . 78.4 t -65.43 -41.96 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.249 -0.907 . . . . 0.0 110.048 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -50.42 -44.86 55.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.197 -0.939 . . . . 0.0 110.159 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -79.04 -26.98 43.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.382 -0.824 . . . . 0.0 110.188 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.795 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -64.42 -23.06 67.16 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.166 -0.959 . . . . 0.0 110.197 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.4 p -118.9 68.87 0.8 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 110.178 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -161.99 -73.73 0.05 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 110.174 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -175.98 135.81 0.29 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.349 -0.845 . . . . 0.0 110.084 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -165.36 121.77 1.03 Allowed Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.235 -0.916 . . . . 0.0 110.21 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.428 ' O ' ' O ' ' A' ' 33' ' ' TRP . 27.9 Cg_exo -56.96 -163.05 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 123.855 1.45 . . . . 0.0 110.26 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.428 ' O ' ' O ' ' A' ' 32' ' ' PRO . 0.6 OUTLIER -57.23 -160.06 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.272 -0.893 . . . . 0.0 110.536 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 166.19 77.59 0.03 OUTLIER Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -66.49 -22.55 51.57 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.977 1.514 . . . . 0.0 110.372 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.2 t -74.0 -152.09 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.202 -0.936 . . . . 0.0 110.276 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.8 m -54.53 161.98 1.28 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.286 -0.884 . . . . 0.0 110.242 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.59 123.48 49.01 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.246 -0.909 . . . . 0.0 110.128 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.795 HD21 ' HB2' ' A' ' 27' ' ' ALA . 1.1 tp -50.97 -28.71 10.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.269 -0.894 . . . . 0.0 110.122 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 3.9 mtm -70.11 -43.42 71.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.193 -0.942 . . . . 0.0 110.152 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.44 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 0.1 OUTLIER -60.6 -35.56 76.42 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.286 -0.884 . . . . 0.0 110.129 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -73.51 -39.55 64.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.274 -0.891 . . . . 0.0 110.121 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.792 HG21 HD11 ' A' ' 80' ' ' LEU . 67.8 mt -64.79 -33.15 61.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 0.0 109.968 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.631 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -74.58 -48.64 25.51 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.213 -0.929 . . . . 0.0 108.956 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.402 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 6.3 m-20 -52.7 -23.03 5.89 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.785 HD22 ' HB2' ' A' ' 20' ' ' ALA . 9.9 mt -77.3 -39.57 47.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.831 -0.543 . . . . 0.0 109.942 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.537 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 81.0 p -48.79 -42.85 37.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.103 -0.998 . . . . 0.0 109.037 179.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.579 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 75.3 m-85 -45.05 -47.66 11.79 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.196 -0.94 . . . . 0.0 109.199 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.533 ' O ' ' C ' ' A' ' 50' ' ' VAL . 2.3 m-80 -66.88 89.83 0.17 Allowed 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.46 0.648 . . . . 0.0 110.421 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.533 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.19 -59.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.681 178.331 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.542 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.7 t -64.57 -65.09 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.157 -0.964 . . . . 0.0 110.424 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.622 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -36.52 -43.63 0.4 Allowed 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.149 0.5 . . . . 0.0 111.173 -177.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.623 ' HA ' HD12 ' A' ' 56' ' ' ILE . 6.5 t80 -58.99 -58.11 10.1 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.242 -0.911 . . . . 0.0 110.454 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.8 t -51.42 -36.0 41.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.258 -0.901 . . . . 0.0 110.46 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.9 -28.9 60.82 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.304 -0.873 . . . . 0.0 110.402 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.686 HD11 ' HB3' ' A' ' 46' ' ' LEU . 22.2 mt -73.03 -70.01 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -0.89 . . . . 0.0 110.472 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.54 ' HE1' ' CZ2' ' A' ' 61' ' ' TRP . 65.2 mmm -46.14 -36.35 5.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.096 -1.003 . . . . 0.0 110.021 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.5 m -53.83 -63.84 1.02 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.325 -0.86 . . . . 0.0 110.197 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -31.44 64.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.066 -1.021 . . . . 0.0 109.478 179.696 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.668 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.8 OUTLIER -63.15 -34.12 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.467 -0.771 . . . . 0.0 109.852 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.54 ' CZ2' ' HE1' ' A' ' 57' ' ' MET . 34.6 m95 -78.15 -29.33 48.65 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.186 -0.946 . . . . 0.0 110.186 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -58.74 7.09 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.243 -0.911 . . . . 0.0 110.197 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.484 ' HB3' ' HB3' ' A' ' 73' ' ' HIS . 2.8 mtt180 -71.04 -15.62 62.56 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.279 -0.888 . . . . 0.0 110.127 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.696 HD22 HD11 ' A' ' 106' ' ' LEU . 13.5 mt -80.73 -8.33 59.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.354 -0.841 . . . . 0.0 110.581 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -82.29 26.47 0.54 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.238 -0.914 . . . . 0.0 111.223 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.579 ' OD1' ' CG ' ' A' ' 109' ' ' PHE . 6.2 m-20 52.92 174.87 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.335 -0.853 . . . . 0.0 110.806 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.479 ' HB3' ' HB2' ' A' ' 70' ' ' ASN . 0.2 OUTLIER -170.32 170.32 7.21 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.693 -0.629 . . . . 0.0 109.868 179.753 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -52.78 -88.14 0.01 OUTLIER Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.484 ' CG ' ' O ' ' A' ' 69' ' ' LYS . 12.5 tttt -111.14 58.52 0.62 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.256 -1.143 . . . . 0.0 109.995 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.479 ' HB2' ' HB3' ' A' ' 67' ' ' HIS . 50.1 m-80 -145.16 16.37 1.53 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.258 -0.902 . . . . 0.0 110.164 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.524 ' CH2' ' HG2' ' A' ' 72' ' ' ARG . 44.0 p-90 -48.07 -25.2 1.33 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.258 -0.901 . . . . 0.0 110.236 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.524 ' HG2' ' CH2' ' A' ' 71' ' ' TRP . 38.7 mtt180 -49.24 -48.04 46.02 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.217 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 63' ' ' ARG . 30.1 m170 -54.19 -47.75 71.72 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.267 -0.896 . . . . 0.0 110.176 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.724 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 47.1 t -47.96 -50.4 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.257 -0.902 . . . . 0.0 110.206 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -52.6 -61.36 2.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.225 -0.922 . . . . 0.0 109.94 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.472 ' HE2' ' O ' ' A' ' 72' ' ' ARG . 8.5 mtmm -52.32 -23.17 5.4 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.239 -0.913 . . . . 0.0 109.476 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' A' ' 74' ' ' VAL . . . -70.91 -46.54 62.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.344 -0.848 . . . . 0.0 109.909 179.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.766 ' HE2' HG23 ' A' ' 123' ' ' VAL . 0.1 OUTLIER -53.19 -37.62 62.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.451 -0.781 . . . . 0.0 109.967 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.483 ' O ' ' HB3' ' A' ' 82' ' ' GLU . 1.9 m -62.86 -63.09 1.31 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.191 -0.943 . . . . 0.0 110.15 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.792 HD11 HG21 ' A' ' 43' ' ' ILE . 15.3 tp -44.86 -69.55 0.13 Allowed 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.199 -0.938 . . . . 0.0 109.39 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.551 ' HE2' HD11 ' A' ' 64' ' ' LEU . 6.5 ttp -39.09 -35.96 0.27 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.495 -0.753 . . . . 0.0 110.811 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.843 ' HB2' HD11 ' A' ' 130' ' ' LEU . 1.6 tm-20 -69.54 -66.16 0.62 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.011 -1.056 . . . . 0.0 110.247 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.559 ' CE1' HG21 ' A' ' 87' ' ' THR . 24.1 t80 -41.76 -48.81 4.32 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.237 -0.914 . . . . 0.0 110.841 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.746 HD11 HD11 ' A' ' 80' ' ' LEU . 7.5 mt -59.85 -48.48 81.52 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.084 -1.01 . . . . 0.0 110.278 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.664 HD12 HD21 ' A' ' 130' ' ' LEU . 76.0 mt -55.08 -23.37 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.189 -0.945 . . . . 0.0 110.008 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -87.73 -77.44 0.35 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.24 -0.912 . . . . 0.0 110.146 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.559 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.9 t -89.64 -20.56 23.54 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 110.258 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.631 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -43.74 -73.93 0.23 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.3 OUTLIER 172.32 175.09 0.09 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.194 -1.18 . . . . 0.0 110.223 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 25.8 mt-10 -73.65 -16.81 61.21 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.235 -0.916 . . . . 0.0 110.168 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -76.57 -35.09 58.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.252 -0.905 . . . . 0.0 110.05 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.555 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 69.9 t -63.06 -51.92 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.211 -0.931 . . . . 0.0 110.053 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 p -61.37 -43.2 99.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.199 -0.938 . . . . 0.0 109.993 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.466 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 6.4 mm-40 -53.18 -49.45 66.67 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.229 -0.919 . . . . 0.0 109.815 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.466 ' OE1' ' CB ' ' A' ' 57' ' ' MET . 5.2 tt0 -55.35 -44.01 75.57 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.489 -0.757 . . . . 0.0 109.62 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -43.21 62.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.336 -0.853 . . . . 0.0 109.432 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -66.73 -35.36 79.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.752 . . . . 0.0 109.829 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 19.7 mt-10 -78.62 -11.06 59.95 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.362 -0.836 . . . . 0.0 109.887 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -136.21 38.45 2.73 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.356 -0.84 . . . . 0.0 110.068 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 3.5 mtp -62.76 -33.29 74.85 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.286 -0.884 . . . . 0.0 110.221 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.459 ' O ' ' HB ' ' A' ' 105' ' ' THR . 4.2 m-30 -59.99 -21.12 60.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.322 -0.861 . . . . 0.0 110.039 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.9 ' O ' HG22 ' A' ' 105' ' ' THR . . . -81.87 -42.68 19.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.347 -0.845 . . . . 0.0 110.139 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.563 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.5 t -75.22 -19.59 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.38 -0.825 . . . . 0.0 109.927 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -91.89 -32.17 15.4 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.291 -0.881 . . . . 0.0 110.115 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.9 HG22 ' O ' ' A' ' 102' ' ' ALA . 14.7 t -58.15 -23.82 56.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.314 -0.866 . . . . 0.0 109.873 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.696 HD11 HD22 ' A' ' 64' ' ' LEU . 11.4 mt -69.19 -41.07 77.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.319 -0.863 . . . . 0.0 110.041 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 6.2 ttpp -49.39 -28.74 5.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.337 -0.852 . . . . 0.0 110.258 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -99.23 -24.24 14.92 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.279 -0.888 . . . . 0.0 110.359 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.579 ' CG ' ' OD1' ' A' ' 66' ' ' ASP . 2.5 t80 -45.47 118.66 1.83 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.235 -0.915 . . . . 0.0 110.172 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.471 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 0.0 OUTLIER -147.9 148.58 30.98 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.317 -0.864 . . . . 0.0 109.958 179.803 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.443 ' HB2' ' O ' ' A' ' 110' ' ' GLN . 1.9 t80 -176.91 127.13 0.16 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.063 -1.023 . . . . 0.0 110.242 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.532 ' O ' HG12 ' A' ' 112' ' ' VAL . 21.6 t -131.44 31.0 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.241 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t70 60.37 -144.84 0.5 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.264 -0.897 . . . . 0.0 110.159 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -66.6 0.89 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.33 -0.857 . . . . 0.0 109.532 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.42 71.76 0.98 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.543 -0.723 . . . . 0.0 110.206 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.401 ' C ' ' CG1' ' A' ' 112' ' ' VAL . . . -117.47 -164.15 13.19 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.475 ' O ' HG13 ' A' ' 112' ' ' VAL . 4.8 mttt -116.67 160.85 20.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -1.143 . . . . 0.0 110.189 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -76.38 93.17 3.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.206 -0.934 . . . . 0.0 110.348 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -122.76 35.79 4.8 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.952 . . . . 0.0 110.213 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.474 ' O ' ' HG3' ' A' ' 124' ' ' ARG . . . -136.89 32.3 2.46 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.558 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.5 p -87.69 -44.22 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.162 -1.199 . . . . 0.0 109.93 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.558 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.5 OUTLIER -45.18 -49.8 11.85 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.421 -0.799 . . . . 0.0 110.104 179.868 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.766 HG23 ' HE2' ' A' ' 78' ' ' MET . 7.1 p -59.49 -37.51 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 0.0 110.384 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.485 ' N ' HG13 ' A' ' 123' ' ' VAL . 14.8 mtm180 -62.75 -68.11 0.36 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.21 -0.931 . . . . 0.0 110.789 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 122' ' ' ASN . 0.0 OUTLIER -52.51 -33.26 44.26 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.311 -0.868 . . . . 0.0 110.96 -179.321 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 0.7 OUTLIER -59.56 -55.23 37.18 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.938 -1.101 . . . . 0.0 110.175 -179.937 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.563 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -53.89 -41.32 67.46 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.235 -0.915 . . . . 0.0 110.44 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.75 -35.66 75.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.247 -0.908 . . . . 0.0 110.421 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -66.72 -50.9 61.29 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.246 -0.909 . . . . 0.0 110.43 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.843 HD11 ' HB2' ' A' ' 82' ' ' GLU . 0.2 OUTLIER -54.11 -29.63 45.6 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.209 -0.932 . . . . 0.0 110.156 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 85.6 t -83.33 -29.6 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.307 -0.871 . . . . 0.0 110.224 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.4 -50.9 41.65 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.354 -0.842 . . . . 0.0 110.402 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.757 HD22 ' OD2' ' A' ' 136' ' ' ASP . 0.8 OUTLIER -63.31 -51.44 66.0 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.211 -0.93 . . . . 0.0 110.382 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.704 HD13 ' O ' ' A' ' 130' ' ' LEU . 0.4 OUTLIER -52.23 -39.17 59.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.178 -0.951 . . . . 0.0 110.301 -179.989 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.476 ' CG ' ' O ' ' A' ' 135' ' ' ARG . 0.5 OUTLIER -114.05 58.89 0.68 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.115 -0.991 . . . . 0.0 110.244 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.757 ' OD2' HD22 ' A' ' 133' ' ' LEU . 5.6 m-20 -80.36 -59.98 2.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.081 -1.012 . . . . 0.0 110.247 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -50.27 160.63 0.36 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.17 -0.956 . . . . 0.0 110.258 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -132.11 150.07 52.24 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.297 -0.877 . . . . 0.0 110.299 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.33 27.29 1.97 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.27 -0.894 . . . . 0.0 110.313 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 50.94 63.12 2.37 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.223 -0.923 . . . . 0.0 110.184 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.457 ' O ' ' HB2' ' A' ' 142' ' ' GLU . 4.5 mtt85 -68.97 -41.35 78.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.269 -0.894 . . . . 0.0 110.247 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 141' ' ' ARG . 0.0 OUTLIER 60.3 -170.08 0.15 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.211 -0.931 . . . . 0.0 110.235 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 61.68 157.37 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.29 -0.881 . . . . 0.0 110.203 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.201 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -115.95 178.52 4.28 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.291 -1.123 . . . . 0.0 110.244 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 2.6 t 179.31 159.21 0.66 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.304 -0.872 . . . . 0.0 110.218 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 51.48 48.2 23.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.266 -0.896 . . . . 0.0 110.242 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.79 -11.1 12.93 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.234 -0.916 . . . . 0.0 110.187 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 50.63 -174.45 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.288 -0.883 . . . . 0.0 110.161 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.1 m -153.19 49.45 0.71 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.237 -0.914 . . . . 0.0 110.227 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.7 t -103.81 -18.16 14.77 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.275 -0.891 . . . . 0.0 110.181 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 95.2 p -160.22 146.61 15.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.93 . . . . 0.0 110.131 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -173.3 74.0 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.244 -0.91 . . . . 0.0 110.256 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.0 ttt180 -141.52 76.47 1.55 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.262 -0.899 . . . . 0.0 110.2 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.8 -35.9 9.28 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.235 -0.916 . . . . 0.0 110.385 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -61.18 -167.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.131 -0.981 . . . . 0.0 110.194 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -125.59 -146.36 0.34 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.211 -0.931 . . . . 0.0 110.19 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.433 ' O ' ' C ' ' A' ' 12' ' ' ASN . 1.7 mttt -49.93 -91.96 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.231 -0.918 . . . . 0.0 110.214 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.433 ' C ' ' O ' ' A' ' 11' ' ' LYS . 7.3 t30 42.47 77.74 0.06 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.208 -0.933 . . . . 0.0 110.231 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.697 HG22 HG22 ' A' ' 14' ' ' VAL . 3.2 mt -76.21 -71.22 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.322 -0.861 . . . . 0.0 110.284 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.697 HG22 HG22 ' A' ' 13' ' ' ILE . 2.7 m -143.06 144.25 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.252 -0.905 . . . . 0.0 110.31 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -116.95 41.06 2.83 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.248 -0.908 . . . . 0.0 110.048 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.86 174.72 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.274 -0.891 . . . . 0.0 110.225 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.41 ' O ' ' CB ' ' A' ' 18' ' ' SER . 16.5 m-85 -78.44 167.35 21.44 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.304 -0.873 . . . . 0.0 110.215 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.41 ' CB ' ' O ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER 174.14 45.8 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 110.031 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -87.98 4.15 46.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.394 -0.816 . . . . 0.0 110.502 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.949 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -66.71 -48.59 68.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.096 -1.002 . . . . 0.0 110.236 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.452 ' HG3' HG13 ' A' ' 22' ' ' ILE . 24.4 pt-20 -43.55 -34.71 1.46 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.105 -0.997 . . . . 0.0 110.153 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.452 HG13 ' HG3' ' A' ' 21' ' ' GLU . 67.4 mt -74.53 -41.19 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.27 -0.894 . . . . 0.0 110.108 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -59.79 -46.5 88.99 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.225 -0.922 . . . . 0.0 110.193 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.919 HG22 HD21 ' A' ' 80' ' ' LEU . 16.8 t -60.27 -35.92 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.232 -0.917 . . . . 0.0 110.1 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -35.69 80.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.232 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -77.17 -34.8 56.33 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.238 -0.914 . . . . 0.0 110.085 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.7 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -63.66 -24.13 67.66 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.29 -0.881 . . . . 0.0 110.119 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.518 HG22 ' O ' ' A' ' 76' ' ' LYS . 56.2 p -115.45 55.16 0.78 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.222 -0.923 . . . . 0.0 110.088 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.8 t -67.92 -63.76 1.0 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.322 -0.861 . . . . 0.0 110.295 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -140.38 -61.23 0.51 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.215 -0.928 . . . . 0.0 110.348 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -142.75 152.83 60.36 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.211 -0.931 . . . . 0.0 110.23 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.447 ' O ' ' CB ' ' A' ' 33' ' ' TRP . 19.5 Cg_endo -65.29 -178.57 0.87 Allowed 'Trans proline' 0 C--N 1.307 -1.658 0 O-C-N 123.983 1.517 . . . . 0.0 110.555 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.447 ' CB ' ' O ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER 67.47 175.28 0.26 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.28 -0.887 . . . . 0.0 110.366 -179.919 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 121.67 -158.02 16.43 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.68 145.56 87.03 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.044 1.549 . . . . 0.0 110.51 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.22 122.86 16.66 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.281 -0.887 . . . . 0.0 110.216 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.3 m -127.82 169.04 14.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.308 -0.87 . . . . 0.0 110.064 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -120.12 50.16 1.33 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.192 -0.942 . . . . 0.0 110.43 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.7 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -110.32 -30.12 7.84 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.12 -0.987 . . . . 0.0 110.255 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 16.6 mtt -62.23 -62.16 1.96 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.271 -0.893 . . . . 0.0 110.242 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.439 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 50.0 m -53.97 -18.53 3.59 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.317 -0.865 . . . . 0.0 110.322 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -57.75 3.59 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 0.0 110.423 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.873 HG21 HD11 ' A' ' 80' ' ' LEU . 4.1 mt -48.34 -30.68 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.144 -0.973 . . . . 0.0 110.143 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.524 ' HA ' HD22 ' A' ' 84' ' ' LEU . . . -71.28 -56.04 6.82 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.095 -1.003 . . . . 0.0 109.558 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.462 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 12.1 t0 -49.98 -24.37 2.55 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.944 -1.098 . . . . 0.0 108.83 179.096 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.949 HD22 ' HB2' ' A' ' 20' ' ' ALA . 2.5 mt -74.04 -43.01 59.4 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.623 -0.673 . . . . 0.0 109.965 179.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.548 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 70.7 p -48.49 -42.97 34.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.163 -0.961 . . . . 0.0 109.324 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.568 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 79.8 m-85 -46.2 -47.48 17.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.261 -0.9 . . . . 0.0 109.237 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.549 ' O ' ' C ' ' A' ' 50' ' ' VAL . 1.1 t30 -68.74 91.34 0.44 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.549 -0.72 . . . . 0.0 110.434 179.558 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.549 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.65 -59.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.159 177.954 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.533 ' H ' HG13 ' A' ' 50' ' ' VAL . 2.6 t -62.65 -64.39 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.033 -1.042 . . . . 0.0 110.076 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.817 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -36.18 -48.09 0.6 Allowed 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.891 -177.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.548 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 13.9 t80 -57.67 -54.17 49.87 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.278 -0.889 . . . . 0.0 110.069 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.8 t -54.5 -24.6 21.2 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.298 -0.876 . . . . 0.0 110.042 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 51' ' ' VAL . 14.4 mm-40 -86.14 -28.02 24.24 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.283 -0.886 . . . . 0.0 109.973 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.858 HD11 ' HB3' ' A' ' 46' ' ' LEU . 6.4 mt -80.67 -70.31 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.345 -0.847 . . . . 0.0 110.147 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.445 ' HG2' ' HG2' ' A' ' 95' ' ' GLN . 0.9 OUTLIER -46.22 -39.42 9.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.322 -0.861 . . . . 0.0 110.031 179.766 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.4 m -56.44 -58.83 6.34 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.288 -0.882 . . . . 0.0 110.062 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 18.9 mmt -63.01 -15.93 58.08 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.253 -0.905 . . . . 0.0 109.968 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.787 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -81.31 -31.4 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 109.653 179.751 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.597 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 11.1 m95 -75.07 -46.13 36.84 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.287 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.47 ' HA ' ' OD1' ' A' ' 65' ' ' ASN . 11.4 mtpt -59.56 -53.18 61.01 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.278 -0.889 . . . . 0.0 109.981 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 85.8 mmt-85 -65.81 -9.63 30.36 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -0.884 . . . . 0.0 109.954 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.799 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 7.0 mt -88.53 -20.63 24.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.35 -0.844 . . . . 0.0 110.44 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.505 ' ND2' ' O ' ' A' ' 65' ' ' ASN . 2.4 p-10 -107.08 38.3 2.15 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.202 -0.936 . . . . 0.0 110.351 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.674 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.6 OUTLIER -55.45 -162.54 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.31 -0.869 . . . . 0.0 110.45 -179.789 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -122.31 -166.51 1.42 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.257 -0.902 . . . . 0.0 110.327 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -86.79 51.88 4.37 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -138.56 -36.73 0.56 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.402 -1.058 . . . . 0.0 110.106 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -144.0 54.2 1.3 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.413 -0.804 . . . . 0.0 110.136 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.422 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 65.6 p-90 -54.74 -17.55 3.6 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.288 -0.883 . . . . 0.0 110.171 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.36 -38.02 18.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.235 -0.916 . . . . 0.0 109.935 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.405 ' ND1' ' N ' ' A' ' 73' ' ' HIS . 2.5 m-70 -61.8 -41.33 97.61 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.353 -0.842 . . . . 0.0 109.861 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.674 HG23 ' HB2' ' A' ' 66' ' ' ASP . 28.7 t -58.08 -52.34 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.481 -0.762 . . . . 0.0 110.076 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.448 ' HB2' HG23 ' A' ' 123' ' ' VAL . 8.5 t80 -49.92 -53.18 27.68 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.335 -0.853 . . . . 0.0 110.15 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.518 ' O ' HG22 ' A' ' 28' ' ' THR . 4.9 mmtt -64.03 -25.55 68.17 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.246 -0.909 . . . . 0.0 110.107 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.799 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -73.38 -23.83 60.23 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.262 -0.899 . . . . 0.0 110.026 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.599 ' SD ' HD13 ' A' ' 106' ' ' LEU . 0.7 OUTLIER -77.12 -41.42 42.03 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.232 -0.917 . . . . 0.0 109.815 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.5 m -58.03 -55.7 31.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.463 -0.773 . . . . 0.0 110.062 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.919 HD21 HG22 ' A' ' 24' ' ' VAL . 31.8 tp -50.84 -57.63 7.98 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.367 -0.833 . . . . 0.0 109.784 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.597 ' HE1' ' CZ3' ' A' ' 61' ' ' TRP . 1.8 ttp -47.29 -32.57 4.8 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.244 -0.91 . . . . 0.0 110.225 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.419 ' O ' ' C ' ' A' ' 83' ' ' TYR . 0.8 OUTLIER -75.17 -68.21 0.58 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.192 -0.943 . . . . 0.0 110.589 -179.908 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.465 ' O ' HG22 ' A' ' 87' ' ' THR . 48.7 t80 -40.33 -37.25 0.64 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 111.027 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.544 ' C ' HG11 ' A' ' 92' ' ' VAL . 52.7 mt -76.09 -40.18 53.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.175 -0.953 . . . . 0.0 110.548 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.884 HG21 HD11 ' A' ' 134' ' ' LEU . 20.4 mt -53.47 -27.41 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 120.974 -1.079 . . . . 0.0 110.186 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.82 -74.78 0.49 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.121 -0.987 . . . . 0.0 110.422 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.496 HG23 ' HB1' ' A' ' 44' ' ' ALA . 11.2 t -86.06 -22.31 27.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.251 -0.905 . . . . 0.0 110.336 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.568 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -43.87 -74.06 0.22 Allowed Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 3.1 t 172.25 160.75 0.11 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.151 -1.205 . . . . 0.0 110.293 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.07 -19.5 32.26 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.27 -0.894 . . . . 0.0 110.087 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -76.52 -38.12 55.65 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.273 -0.892 . . . . 0.0 110.187 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.544 HG11 ' C ' ' A' ' 84' ' ' LEU . 71.6 t -60.01 -28.07 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.291 -0.881 . . . . 0.0 110.084 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.4 p -86.06 -38.54 17.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.234 -0.916 . . . . 0.0 110.162 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -58.84 -57.49 12.8 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.292 -0.88 . . . . 0.0 109.98 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.445 ' HG2' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -52.75 -35.74 56.72 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.4 -0.813 . . . . 0.0 109.875 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.495 ' O ' ' N ' ' A' ' 100' ' ' MET . 0.7 OUTLIER -59.55 -43.42 93.54 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.328 -0.858 . . . . 0.0 109.778 179.587 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -66.6 -35.93 81.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.322 179.286 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -80.84 -10.05 59.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.498 -0.752 . . . . 0.0 109.721 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -135.64 26.87 3.38 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.43 -0.794 . . . . 0.0 109.848 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.495 ' N ' ' O ' ' A' ' 96' ' ' CYS . 0.2 OUTLIER -61.53 -29.83 70.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.354 -0.841 . . . . 0.0 109.917 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -57.82 -27.31 63.03 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.329 -0.857 . . . . 0.0 109.816 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.774 ' O ' HG22 ' A' ' 105' ' ' THR . . . -72.13 -41.52 67.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.41 -0.806 . . . . 0.0 110.043 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.463 ' CG1' HG23 ' A' ' 131' ' ' VAL . 3.3 t -76.9 -19.92 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.364 -0.835 . . . . 0.0 109.946 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.612 ' HG2' HG21 ' A' ' 131' ' ' VAL . 1.1 mt-30 -91.28 -23.75 20.06 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.276 -0.89 . . . . 0.0 110.124 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.774 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.7 t -75.85 -24.31 55.76 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.252 -0.905 . . . . 0.0 110.098 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.754 HD11 HD22 ' A' ' 64' ' ' LEU . 10.0 mt -61.05 -42.67 98.92 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.262 -0.899 . . . . 0.0 109.967 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.513 ' HA ' ' CA ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -59.74 -22.75 62.49 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.198 -0.939 . . . . 0.0 110.014 179.762 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -97.88 -17.97 18.97 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.304 -0.872 . . . . 0.0 110.189 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.488 ' C ' ' CD1' ' A' ' 109' ' ' PHE . 1.4 t80 -67.15 91.77 0.24 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.224 -0.922 . . . . 0.0 110.013 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.422 ' O ' ' HB2' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -97.94 135.8 39.14 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.34 -0.85 . . . . 0.0 110.255 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.422 ' HB2' ' O ' ' A' ' 110' ' ' GLN . 0.3 OUTLIER -178.19 115.41 0.08 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.278 -0.889 . . . . 0.0 110.163 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.656 ' O ' HG12 ' A' ' 112' ' ' VAL . 98.1 t -109.96 57.82 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.271 -0.893 . . . . 0.0 110.182 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.9 t70 51.29 -138.79 1.02 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.19 -0.943 . . . . 0.0 110.101 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.506 ' CD ' ' N ' ' A' ' 114' ' ' ARG . 0.0 OUTLIER -89.58 -65.94 0.97 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.192 -0.943 . . . . 0.0 109.447 179.76 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -124.18 36.1 4.69 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.558 -0.714 . . . . 0.0 110.118 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.454 ' CA ' HG12 ' A' ' 112' ' ' VAL . . . -65.86 -153.59 0.19 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.47 ' O ' ' O ' ' A' ' 118' ' ' ASP . 2.1 ttpm? -155.95 87.12 1.06 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.291 -1.123 . . . . 0.0 110.296 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.47 ' O ' ' O ' ' A' ' 117' ' ' LYS . 1.7 t70 39.41 94.96 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.476 -0.765 . . . . 0.0 110.736 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.419 ' HG3' ' NE1' ' A' ' 71' ' ' TRP . 12.9 pt20 -143.34 10.91 1.7 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.151 -0.968 . . . . 0.0 110.442 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.453 ' O ' ' HB ' ' A' ' 123' ' ' VAL . . . -104.38 -3.95 43.94 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.594 HG12 ' N ' ' A' ' 122' ' ' ASN . 6.6 t -43.01 -73.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.279 -1.13 . . . . 0.0 111.031 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.594 ' N ' HG12 ' A' ' 121' ' ' VAL . 16.2 m-80 -33.63 -33.54 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.766 -0.583 . . . . 0.0 111.197 -178.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.599 HG22 HG12 ' A' ' 74' ' ' VAL . 1.7 t -77.58 -49.2 22.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.916 -1.115 . . . . 0.0 109.703 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.513 ' CA ' ' HA ' ' A' ' 107' ' ' LYS . 10.9 mtm-85 -60.79 -56.6 19.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.109 -0.995 . . . . 0.0 110.732 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -62.1 -51.11 69.22 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.271 -0.893 . . . . 0.0 110.956 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 122' ' ' ASN . 0.6 OUTLIER -50.43 -48.32 56.31 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.012 -1.055 . . . . 0.0 110.255 -179.688 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -55.19 -46.04 75.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.36 -0.838 . . . . 0.0 110.591 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -62.12 -35.48 78.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.115 -0.991 . . . . 0.0 110.414 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -60.36 -51.48 69.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -0.913 . . . . 0.0 110.555 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.76 HD21 ' CD1' ' A' ' 85' ' ' ILE . 2.1 tt -53.9 -36.76 63.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.14 -0.975 . . . . 0.0 110.295 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.612 HG21 ' HG2' ' A' ' 104' ' ' GLN . 76.5 t -74.87 -27.1 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.353 -0.842 . . . . 0.0 110.144 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 136' ' ' ASP . . . -68.42 -51.5 43.16 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.374 -0.829 . . . . 0.0 110.576 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.58 HD11 HD12 ' A' ' 134' ' ' LEU . 2.2 pp -63.83 -26.04 68.44 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.202 -0.936 . . . . 0.0 110.384 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.884 HD11 HG21 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -87.62 -13.69 42.05 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.268 -0.895 . . . . 0.0 110.106 179.881 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -156.53 83.85 0.97 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.338 -0.851 . . . . 0.0 110.155 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.455 ' HB2' ' O ' ' A' ' 132' ' ' ALA . 6.6 t70 -122.02 -22.94 5.52 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.299 -0.875 . . . . 0.0 110.444 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -57.44 104.49 0.18 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.147 -0.97 . . . . 0.0 110.217 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -143.76 76.49 1.52 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.267 -0.896 . . . . 0.0 110.206 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -52.13 -60.84 2.73 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.271 -0.893 . . . . 0.0 110.249 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.1 mp -81.62 161.65 23.39 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.35 -0.844 . . . . 0.0 110.203 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -91.06 84.92 5.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.285 -0.884 . . . . 0.0 110.183 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' A' ' 144' ' ' ARG . 2.6 mp0 -86.36 -47.75 9.08 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.22 -0.925 . . . . 0.0 110.111 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 47.84 -91.12 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.335 -0.853 . . . . 0.0 110.182 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 142' ' ' GLU . 1.3 tpt180 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.211 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 109.466 -1.453 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 20.6 p -65.72 132.15 48.07 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.284 -1.127 . . . . 0.0 110.202 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 4.7 t 56.61 -153.8 0.35 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.239 -0.913 . . . . 0.0 110.227 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 0' ' ' ARG . . . . . 0.524 ' O ' ' N ' ' A' ' 2' ' ' SER . 20.3 mtm105 -136.53 -154.47 0.56 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.273 -0.892 . . . . 0.0 110.182 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mtp 48.54 -90.5 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.295 -0.878 . . . . 0.0 110.237 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.524 ' N ' ' O ' ' A' ' 0' ' ' ARG . 54.8 p -162.69 172.91 14.58 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 110.173 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 p -106.77 -6.82 17.52 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.248 -0.908 . . . . 0.0 110.146 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 t 59.25 -172.98 0.11 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.287 -0.883 . . . . 0.0 110.119 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.5 m -122.74 174.6 7.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.183 -0.948 . . . . 0.0 110.223 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 mp -122.48 146.48 47.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.231 -0.918 . . . . 0.0 110.193 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.22 17.86 1.08 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.215 -0.928 . . . . 0.0 110.146 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -64.77 156.18 31.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.31 -0.869 . . . . 0.0 110.26 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -101.45 150.47 23.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.284 -0.885 . . . . 0.0 110.243 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.4 mmt -104.92 -63.46 1.22 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.285 -0.885 . . . . 0.0 110.188 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -66.16 171.64 4.5 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.331 -0.855 . . . . 0.0 110.225 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.414 ' OD1' ' O ' ' A' ' 12' ' ' ASN . 7.3 p30 -100.1 113.32 25.86 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.303 -0.873 . . . . 0.0 110.151 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 tt -98.78 1.34 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.305 -0.872 . . . . 0.0 110.322 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 31.5 t -74.23 104.96 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.191 -0.943 . . . . 0.0 110.237 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -148.33 146.84 28.72 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 110.299 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 -143.45 79.07 1.62 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.279 -0.888 . . . . 0.0 110.115 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.438 ' CD2' ' OE2' ' A' ' 19' ' ' GLU . 38.5 p90 -95.59 149.76 21.09 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.213 -0.929 . . . . 0.0 110.302 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.466 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 0.5 OUTLIER -126.57 -30.8 2.79 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.299 -0.876 . . . . 0.0 110.126 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 18' ' ' SER . 28.1 mt-10 56.28 17.44 2.83 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.274 -0.891 . . . . 0.0 110.422 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.76 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -67.85 -50.14 58.26 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.184 -0.947 . . . . 0.0 110.141 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HG3' HG13 ' A' ' 22' ' ' ILE . 16.7 pt-20 -49.21 -29.68 5.97 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.22 -0.925 . . . . 0.0 110.205 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.465 HG13 ' HG3' ' A' ' 21' ' ' GLU . 55.8 mt -74.71 -39.89 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.206 -0.934 . . . . 0.0 110.011 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.675 ' O ' HD11 ' A' ' 43' ' ' ILE . 14.7 mttp -70.66 -23.99 62.61 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.383 -0.823 . . . . 0.0 110.073 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.744 HG21 ' HA ' ' A' ' 56' ' ' ILE . 72.3 t -79.55 -34.1 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.249 -0.907 . . . . 0.0 110.152 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -40.38 87.73 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.296 -0.877 . . . . 0.0 110.263 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -44.12 54.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.335 -0.853 . . . . 0.0 110.176 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.631 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -57.06 -20.55 25.59 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.242 -0.911 . . . . 0.0 110.114 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.546 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 2.5 p -93.1 -83.63 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.214 -0.929 . . . . 0.0 110.077 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.0 t -69.59 98.67 1.18 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.165 -0.959 . . . . 0.0 110.196 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -106.8 29.19 7.23 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.316 -0.865 . . . . 0.0 110.235 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.582 ' N ' ' CD ' ' A' ' 32' ' ' PRO . 0.4 OUTLIER -54.14 -48.12 95.21 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.28 -0.888 . . . . 0.0 110.157 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.582 ' CD ' ' N ' ' A' ' 31' ' ' ASP . 37.1 Cg_exo -56.27 174.69 0.32 Allowed 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.018 1.536 . . . . 0.0 110.334 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -102.11 -177.47 3.42 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.265 -0.897 . . . . 0.0 110.519 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 136.09 149.27 5.7 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -67.6 177.54 3.97 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 O-C-N 124.056 1.556 . . . . 0.0 110.526 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.7 m -132.1 152.06 51.43 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.329 -0.857 . . . . 0.0 109.99 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 38' ' ' SER . 0.4 OUTLIER -143.23 -59.2 0.42 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.231 -0.918 . . . . 0.0 110.355 -179.875 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.418 ' HB2' ' O ' ' A' ' 37' ' ' SER . 5.0 t 176.21 53.25 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.203 -0.935 . . . . 0.0 110.121 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.631 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 13.1 tp -65.07 -35.18 80.33 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.248 -0.908 . . . . 0.0 110.333 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.09 -42.61 99.65 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.15 -0.969 . . . . 0.0 110.316 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.422 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.3 OUTLIER -61.53 -33.46 73.86 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.118 -0.989 . . . . 0.0 110.193 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.08 -44.23 60.79 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.195 -0.94 . . . . 0.0 110.0 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.726 HG21 HD11 ' A' ' 80' ' ' LEU . 85.4 mt -59.64 -31.34 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.192 -0.942 . . . . 0.0 110.021 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.731 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -72.58 -52.79 14.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.924 . . . . 0.0 109.522 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.465 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 27.9 t0 -51.52 -22.39 3.14 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.988 -1.07 . . . . 0.0 108.679 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.76 HD13 ' CB ' ' A' ' 20' ' ' ALA . 15.1 mt -77.68 -40.64 40.8 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.593 -0.692 . . . . 0.0 109.908 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.52 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 68.0 p -49.64 -42.95 46.4 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.154 -0.967 . . . . 0.0 109.407 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.545 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 85.3 m-85 -44.88 -45.37 10.25 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.241 -0.912 . . . . 0.0 109.486 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.534 ' O ' ' N ' ' A' ' 51' ' ' VAL . 3.4 t-20 -71.47 92.65 1.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.511 -0.743 . . . . 0.0 110.331 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.523 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.75 -56.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.863 178.301 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.54 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.8 t -64.21 -65.7 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 120.954 -1.091 . . . . 0.0 110.495 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.684 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.51 -45.01 0.7 Allowed 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 121.169 0.509 . . . . 0.0 110.972 -177.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.585 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 16.7 t80 -60.19 -53.82 53.14 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.32 -0.862 . . . . 0.0 110.425 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' A' ' 58' ' ' SER . 9.2 t -56.62 -21.07 24.46 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.221 -0.924 . . . . 0.0 110.152 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -93.75 -22.46 18.69 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -0.894 . . . . 0.0 110.368 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.744 ' HA ' HG21 ' A' ' 24' ' ' VAL . 30.1 mt -81.67 -55.95 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.242 -0.911 . . . . 0.0 110.203 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.602 ' HE2' ' HG2' ' A' ' 95' ' ' GLN . 90.8 mmm -58.6 -36.12 73.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.196 -0.94 . . . . 0.0 109.705 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' ' 54' ' ' SER . 0.3 OUTLIER -59.02 -55.3 36.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.332 -0.855 . . . . 0.0 109.801 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.554 ' HB2' HG11 ' A' ' 24' ' ' VAL . 3.0 mmt -63.29 -25.08 68.15 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.225 -0.922 . . . . 0.0 109.766 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.685 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -73.67 -31.0 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.519 -0.738 . . . . 0.0 109.824 179.817 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.468 ' CZ2' ' HE1' ' A' ' 81' ' ' MET . 16.4 m95 -76.39 -56.99 4.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.127 -0.983 . . . . 0.0 110.143 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.13 -50.84 10.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.247 -0.908 . . . . 0.0 110.214 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -68.38 -31.87 71.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.212 -0.93 . . . . 0.0 110.151 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.793 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 7.4 mt -65.25 -26.82 68.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.29 -0.882 . . . . 0.0 110.054 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -101.15 36.52 1.97 Allowed 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.338 -0.851 . . . . 0.0 109.933 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 67' ' ' HIS . 2.0 t70 -66.82 177.95 1.5 Allowed 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.46 -0.775 . . . . 0.0 110.094 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.472 ' HB3' ' O ' ' A' ' 66' ' ' ASP . 24.7 p80 178.79 178.54 0.43 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.501 -0.75 . . . . 0.0 110.179 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.413 ' O ' ' C ' ' A' ' 69' ' ' LYS . . . 59.55 -88.15 0.02 OUTLIER Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.413 ' C ' ' O ' ' A' ' 68' ' ' GLY . 8.9 mmtt -43.68 -87.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.122 -1.223 . . . . 0.0 110.186 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -159.24 149.49 19.22 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.394 -0.816 . . . . 0.0 110.325 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.408 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 51.2 p-90 -80.37 7.1 10.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.264 -0.898 . . . . 0.0 110.118 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.54 -37.74 58.29 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.264 -0.897 . . . . 0.0 110.215 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -68.04 -32.03 72.11 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.303 -0.873 . . . . 0.0 110.204 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.677 HG12 ' HE2' ' A' ' 78' ' ' MET . 27.1 t -64.71 -59.4 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.196 -0.94 . . . . 0.0 110.2 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -47.02 -53.42 12.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.266 -0.896 . . . . 0.0 109.936 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.546 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -59.27 -33.07 70.61 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.239 -0.913 . . . . 0.0 109.63 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.793 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -66.71 -28.85 68.76 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.287 -0.883 . . . . 0.0 109.645 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.677 ' HE2' HG12 ' A' ' 74' ' ' VAL . 1.8 mtt -71.0 -32.92 69.86 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.282 -0.886 . . . . 0.0 109.923 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.0 m -67.87 -37.1 81.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.326 -0.859 . . . . 0.0 110.307 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.726 HD11 HG21 ' A' ' 43' ' ' ILE . 23.1 tp -73.06 -37.85 66.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.213 -0.929 . . . . 0.0 110.022 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.613 ' HG2' HD21 ' A' ' 130' ' ' LEU . 3.2 ttt -73.61 -27.0 61.06 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.173 -0.955 . . . . 0.0 109.946 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.5 ' HG3' HD12 ' A' ' 130' ' ' LEU . 1.8 tt0 -80.05 -37.67 33.5 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 110.015 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.422 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 37.1 t80 -72.7 -46.06 55.64 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.386 -0.821 . . . . 0.0 110.349 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.731 HD23 ' HB2' ' A' ' 44' ' ' ALA . 76.3 mt -66.63 -43.54 84.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.266 -0.896 . . . . 0.0 110.34 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.66 HD13 HD11 ' A' ' 134' ' ' LEU . 8.6 mt -53.41 -19.32 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.107 -0.996 . . . . 0.0 109.681 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -96.22 -79.32 0.45 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.272 -0.893 . . . . 0.0 110.18 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 88' ' ' GLY . 10.2 t -80.08 -23.63 41.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.221 -0.924 . . . . 0.0 110.288 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.56 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -43.97 -71.11 0.48 Allowed Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.466 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.6 OUTLIER 171.78 160.59 0.1 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.203 -1.175 . . . . 0.0 110.174 179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -59.61 -16.17 23.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.219 -0.925 . . . . 0.0 110.093 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.0 mmt180 -79.79 -40.97 27.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.281 -0.887 . . . . 0.0 110.323 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.458 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 53.1 t -57.91 -38.17 64.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.151 -0.968 . . . . 0.0 109.933 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.2 m -71.49 -42.69 67.73 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.177 -0.952 . . . . 0.0 109.779 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -56.13 -39.73 72.7 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.287 -0.883 . . . . 0.0 109.777 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.602 ' HG2' ' HE2' ' A' ' 57' ' ' MET . 3.9 tt0 -68.64 -38.02 80.17 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.376 -0.827 . . . . 0.0 109.296 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.681 ' SG ' HD22 ' A' ' 134' ' ' LEU . 51.8 t -58.1 -28.62 64.78 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.028 -1.045 . . . . 0.0 108.807 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -87.2 -20.99 26.15 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.519 -0.738 . . . . 0.0 110.04 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.1 pt-20 -84.52 -20.01 32.3 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.104 -0.998 . . . . 0.0 109.932 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -124.7 44.49 2.76 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.394 -0.816 . . . . 0.0 110.099 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.12 -34.73 76.9 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.247 -0.908 . . . . 0.0 110.106 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -59.94 -21.44 61.17 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.362 -0.836 . . . . 0.0 110.01 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.756 ' O ' HG22 ' A' ' 105' ' ' THR . . . -82.46 -42.39 18.57 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.327 -0.858 . . . . 0.0 110.292 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.555 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.6 t -75.06 -18.82 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.325 -0.859 . . . . 0.0 110.268 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.501 ' HG2' HG21 ' A' ' 131' ' ' VAL . 0.2 OUTLIER -95.33 -27.77 15.3 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.212 -0.93 . . . . 0.0 110.649 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.756 HG22 ' O ' ' A' ' 102' ' ' ALA . 9.7 t -64.95 -14.67 60.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.089 -1.007 . . . . 0.0 110.094 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.723 HD11 HD22 ' A' ' 64' ' ' LEU . 8.9 mt -65.26 -34.23 77.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.356 -0.84 . . . . 0.0 110.197 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -13.4 51.71 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.343 -0.848 . . . . 0.0 110.428 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.444 ' O ' ' C ' ' A' ' 109' ' ' PHE . 2.1 t0 -90.36 -11.15 41.45 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.205 -0.934 . . . . 0.0 110.453 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.463 ' HB2' ' O ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -37.78 144.73 0.08 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.518 -0.739 . . . . 0.0 110.746 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -138.44 123.27 18.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.237 -0.914 . . . . 0.0 110.045 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -175.67 135.02 0.3 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.215 -0.928 . . . . 0.0 110.211 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.54 ' O ' HG12 ' A' ' 112' ' ' VAL . 37.1 t -131.99 0.41 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.295 -0.878 . . . . 0.0 110.179 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.2 t0 49.41 -146.19 0.38 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.27 -0.894 . . . . 0.0 110.119 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.569 ' CG ' ' N ' ' A' ' 115' ' ' ASP . 9.8 ptt180 -97.59 -45.97 6.2 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.257 -0.902 . . . . 0.0 109.95 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.569 ' N ' ' CG ' ' A' ' 114' ' ' ARG . 12.1 t70 -40.24 -27.95 0.05 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.593 -0.692 . . . . 0.0 110.36 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.506 ' HA2' ' CG1' ' A' ' 112' ' ' VAL . . . 88.4 -179.5 46.39 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.6 tttp 62.91 139.49 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.274 -1.133 . . . . 0.0 110.305 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.51 137.98 46.67 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.328 -0.857 . . . . 0.0 110.161 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -132.24 33.68 3.84 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.203 -0.936 . . . . 0.0 110.18 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -115.49 25.65 9.59 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.546 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p -78.06 -44.0 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.154 -1.204 . . . . 0.0 110.042 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.546 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.6 OUTLIER -49.08 -50.96 34.32 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.488 -0.758 . . . . 0.0 110.007 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.598 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 6.4 p -74.24 -20.61 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.072 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.457 ' HB3' ' O ' ' A' ' 121' ' ' VAL . 9.9 ttt180 -68.29 -65.29 0.72 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.153 -0.967 . . . . 0.0 110.392 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -62.07 -28.92 69.95 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.382 -0.824 . . . . 0.0 110.47 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -58.55 7.95 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.063 -1.023 . . . . 0.0 110.082 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -51.87 -40.27 60.35 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.202 -0.936 . . . . 0.0 110.0 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -63.36 -36.85 85.09 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.282 -0.886 . . . . 0.0 110.375 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.49 -49.81 73.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.253 -0.904 . . . . 0.0 110.404 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.613 HD21 ' HG2' ' A' ' 81' ' ' MET . 0.9 OUTLIER -56.98 -28.84 62.73 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.963 -1.086 . . . . 0.0 109.654 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.501 HG21 ' HG2' ' A' ' 104' ' ' GLN . 55.7 t -78.53 -27.78 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.282 -0.886 . . . . 0.0 109.728 179.524 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -75.61 -57.41 3.9 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.378 -0.826 . . . . 0.0 110.374 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.95 -34.85 4.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.218 -0.926 . . . . 0.0 110.446 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.681 HD22 ' SG ' ' A' ' 96' ' ' CYS . 0.4 OUTLIER -83.06 -33.65 26.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.134 -0.979 . . . . 0.0 110.394 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -119.28 102.66 8.86 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.165 -0.959 . . . . 0.0 110.189 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -151.98 -78.15 0.12 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.2 -0.938 . . . . 0.0 110.269 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -157.49 147.36 20.46 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.25 -0.906 . . . . 0.0 110.303 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -60.98 87.87 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.337 -0.852 . . . . 0.0 110.354 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.71 93.04 8.7 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.295 -0.878 . . . . 0.0 110.253 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.8 mt -112.7 -82.92 0.59 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.179 -0.951 . . . . 0.0 110.178 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.63 149.06 42.03 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.256 -0.902 . . . . 0.0 110.17 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.36 64.77 1.25 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.893 . . . . 0.0 110.119 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -92.64 -84.68 0.28 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.334 -0.853 . . . . 0.0 110.294 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 6.8 ttt-85 . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.257 -179.874 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 50.3 m -152.72 147.84 26.56 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.161 -1.2 . . . . 0.0 110.346 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 1.8 m -143.8 -55.19 0.37 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.377 -0.827 . . . . 0.0 110.137 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.5 -78.93 0.48 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.207 -0.933 . . . . 0.0 110.234 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 ptp -114.49 169.3 9.15 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.281 -0.887 . . . . 0.0 110.141 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -179.11 -171.8 0.22 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.285 -0.884 . . . . 0.0 110.32 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 99.3 m -50.69 104.4 0.07 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.322 -0.861 . . . . 0.0 110.21 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.3 p -156.5 102.4 2.07 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.247 -0.908 . . . . 0.0 110.165 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.5 p -105.21 176.92 5.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.224 -0.922 . . . . 0.0 110.262 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.0 mt -94.34 145.25 24.89 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.231 -0.918 . . . . 0.0 110.255 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.32 85.17 5.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.888 . . . . 0.0 110.2 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.87 -24.9 8.43 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.276 -0.89 . . . . 0.0 110.219 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -91.89 105.19 17.51 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.255 -0.903 . . . . 0.0 110.188 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 29.8 mtp -106.38 -151.54 0.46 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.306 -0.871 . . . . 0.0 110.142 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.2 ptmt -52.09 154.46 2.27 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.264 -0.897 . . . . 0.0 110.269 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -115.43 -178.2 3.32 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.276 -0.89 . . . . 0.0 110.182 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 98.1 mt -61.14 121.49 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.308 -0.87 . . . . 0.0 110.269 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.447 ' O ' ' C ' ' A' ' 15' ' ' HIS . 2.9 m -123.52 144.86 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.292 -0.88 . . . . 0.0 110.196 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.447 ' C ' ' O ' ' A' ' 14' ' ' VAL . 5.1 t60 38.49 63.92 0.81 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.494 -0.754 . . . . 0.0 110.633 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -53.1 162.74 0.62 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.218 -0.926 . . . . 0.0 110.219 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -104.44 172.07 6.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.217 -0.927 . . . . 0.0 110.09 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 61.41 68.03 0.74 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.25 -0.906 . . . . 0.0 110.144 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -124.65 -3.65 7.77 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.27 -0.894 . . . . 0.0 110.29 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.617 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -58.42 -50.34 74.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.152 -0.968 . . . . 0.0 110.133 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' A' ' 20' ' ' ALA . 8.0 pt-20 -43.23 -29.64 0.41 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.27 -0.893 . . . . 0.0 110.08 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.7 mt -82.59 -43.13 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.238 -0.914 . . . . 0.0 110.073 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.624 ' O ' HD11 ' A' ' 43' ' ' ILE . 8.0 mmtm -57.11 -32.34 66.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.311 -0.868 . . . . 0.0 110.111 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.965 HG13 ' CD2' ' A' ' 80' ' ' LEU . 87.0 t -76.34 -43.6 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.986 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.18 -39.22 74.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.316 -0.865 . . . . 0.0 110.126 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -83.18 -29.48 28.53 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.393 -0.817 . . . . 0.0 110.154 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.893 ' HB2' HD12 ' A' ' 39' ' ' LEU . . . -62.14 -25.05 67.52 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.299 -0.876 . . . . 0.0 110.014 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.501 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 28.3 p -100.84 33.77 2.69 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.259 -0.901 . . . . 0.0 110.111 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 34.0 t -167.58 105.87 0.53 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 0.0 110.183 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -174.15 167.98 4.1 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.249 -0.907 . . . . 0.0 110.204 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.429 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 2.5 p30 -86.87 147.95 44.46 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.313 -0.867 . . . . 0.0 110.176 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.45 ' O ' ' CB ' ' A' ' 33' ' ' TRP . 35.2 Cg_exo -56.09 -174.99 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 123.982 1.517 . . . . 0.0 110.275 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.45 ' CB ' ' O ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER 66.09 174.54 0.23 Allowed 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.212 -0.93 . . . . 0.0 110.497 -179.879 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 113.92 95.94 2.15 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -62.57 -34.34 75.3 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 124.006 1.529 . . . . 0.0 110.262 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.4 p -114.6 146.98 40.16 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 110.057 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.412 ' O ' ' OG ' ' A' ' 37' ' ' SER . 1.4 p -152.71 113.07 4.04 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.264 -0.898 . . . . 0.0 110.268 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.08 61.48 0.61 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.276 -0.89 . . . . 0.0 110.047 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.893 HD12 ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -131.46 -39.71 1.13 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.217 -0.927 . . . . 0.0 110.318 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.2 mmm -75.84 -60.67 2.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.235 -0.916 . . . . 0.0 110.464 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 86.0 p -48.93 -29.33 4.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.167 -0.958 . . . . 0.0 110.366 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -74.36 -53.5 9.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.264 -0.897 . . . . 0.0 110.403 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.843 HG21 HD11 ' A' ' 80' ' ' LEU . 44.4 mt -53.52 -39.62 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -0.925 . . . . 0.0 110.112 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.702 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -66.36 -51.08 60.78 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.076 -1.015 . . . . 0.0 109.168 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.48 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -56.22 -19.33 13.37 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.088 -1.008 . . . . 0.0 108.862 178.874 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.705 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 13.5 mt -82.76 -38.53 23.08 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.572 -0.705 . . . . 0.0 110.092 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.591 HG21 HG21 ' A' ' 92' ' ' VAL . 61.7 p -51.75 -43.28 62.86 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.078 -1.014 . . . . 0.0 109.223 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.48 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 88.3 m-85 -43.18 -43.41 4.64 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.475 -0.765 . . . . 0.0 109.485 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.543 ' O ' ' N ' ' A' ' 51' ' ' VAL . 2.6 t-20 -73.17 93.44 1.84 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.558 -0.714 . . . . 0.0 110.328 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.519 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.95 -56.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.908 178.37 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.543 ' N ' ' O ' ' A' ' 49' ' ' ASN . 3.1 t -66.19 -66.29 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.044 -1.035 . . . . 0.0 110.701 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.705 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.64 -46.09 0.84 Allowed 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.022 -177.615 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.532 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 3.1 t80 -56.44 -53.91 51.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.29 -0.881 . . . . 0.0 110.037 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.2 m -57.18 -21.83 36.09 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.144 -0.973 . . . . 0.0 110.025 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -88.95 -24.64 22.38 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.357 -0.839 . . . . 0.0 110.189 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.758 HG12 HG23 ' A' ' 43' ' ' ILE . 4.1 mt -79.15 -70.32 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.405 -0.809 . . . . 0.0 110.229 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.456 ' N ' HG22 ' A' ' 56' ' ' ILE . 5.0 mtp -46.17 -38.33 8.15 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.221 -0.925 . . . . 0.0 109.772 179.681 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -54.69 -62.08 1.89 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.358 -0.838 . . . . 0.0 110.048 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -23.11 58.86 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.969 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.769 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -73.95 -31.75 31.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.295 -0.878 . . . . 0.0 109.834 179.718 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.79 ' CZ2' ' HE1' ' A' ' 81' ' ' MET . 14.0 m95 -76.29 -63.44 1.33 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.138 -0.976 . . . . 0.0 110.265 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -44.83 -45.43 10.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.297 -0.877 . . . . 0.0 110.405 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -69.69 -34.15 73.52 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.286 -0.884 . . . . 0.0 110.386 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.979 HD22 HD11 ' A' ' 106' ' ' LEU . 7.5 mt -57.51 -20.52 31.99 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.221 -0.925 . . . . 0.0 110.42 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.457 ' O ' ' O ' ' A' ' 66' ' ' ASP . 3.4 m120 -107.44 39.88 1.81 Allowed 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.252 -0.905 . . . . 0.0 110.136 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.483 ' OD2' ' HB2' ' A' ' 73' ' ' HIS . 1.7 t0 -55.05 -163.16 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.302 -0.874 . . . . 0.0 110.356 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.47 -176.08 5.94 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.347 -0.846 . . . . 0.0 110.257 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.492 ' HA3' ' CD2' ' A' ' 111' ' ' TYR . . . -72.75 -56.73 5.77 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -70.33 -23.4 62.82 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.254 -1.145 . . . . 0.0 110.312 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.458 ' O ' ' OD2' ' A' ' 66' ' ' ASP . 40.0 m-20 -96.38 47.57 1.08 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.317 -0.864 . . . . 0.0 110.501 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.523 ' CE2' ' CD ' ' A' ' 119' ' ' GLN . 47.7 p-90 -77.3 -11.02 59.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.228 -0.92 . . . . 0.0 110.228 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.76 -28.52 22.68 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.262 -0.899 . . . . 0.0 110.018 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.483 ' HB2' ' OD2' ' A' ' 66' ' ' ASP . 0.3 OUTLIER -78.1 -35.12 49.65 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.269 -0.894 . . . . 0.0 110.021 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.776 HG22 ' O ' ' A' ' 64' ' ' LEU . 13.3 t -60.65 -55.31 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.338 -0.851 . . . . 0.0 109.758 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -52.48 -52.85 52.26 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.35 -0.844 . . . . 0.0 109.874 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.501 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -61.13 -24.84 66.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.314 -0.866 . . . . 0.0 109.991 179.715 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.765 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -74.64 -34.02 62.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.309 -0.869 . . . . 0.0 109.997 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.624 ' SD ' ' HB2' ' A' ' 127' ' ' ALA . 0.0 OUTLIER -66.87 -30.87 71.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.371 -0.831 . . . . 0.0 109.462 179.513 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.2 m -66.73 -64.05 0.94 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.499 -0.75 . . . . 0.0 109.946 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.965 ' CD2' HG13 ' A' ' 24' ' ' VAL . 29.9 tp -46.87 -46.81 21.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.322 -0.861 . . . . 0.0 110.135 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' MET . . . . . 1.012 ' HG2' HD21 ' A' ' 130' ' ' LEU . 19.6 ttm -56.53 -42.99 79.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.114 -0.991 . . . . 0.0 110.205 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.718 ' HA ' HD12 ' A' ' 85' ' ' ILE . 62.6 tt0 -68.49 -65.91 0.64 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.243 -0.91 . . . . 0.0 110.336 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.582 ' O ' HG22 ' A' ' 87' ' ' THR . 57.9 t80 -37.52 -47.78 0.94 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.454 -0.779 . . . . 0.0 110.791 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.702 HD23 ' HB2' ' A' ' 44' ' ' ALA . 68.4 mt -68.03 -43.93 77.64 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.842 . . . . 0.0 110.222 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.001 HD13 HD11 ' A' ' 134' ' ' LEU . 23.5 mt -47.9 -29.54 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.033 -1.042 . . . . 0.0 109.75 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.63 -72.6 0.61 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.326 -0.859 . . . . 0.0 110.111 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.582 HG22 ' O ' ' A' ' 83' ' ' TYR . 8.0 t -83.8 -27.44 28.8 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.278 -0.889 . . . . 0.0 110.108 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.558 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -44.16 -85.83 0.01 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.466 ' O ' ' HB ' ' A' ' 92' ' ' VAL . 1.3 t -175.78 154.44 1.54 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -1.184 . . . . 0.0 110.382 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -47.68 -44.98 27.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.247 -0.908 . . . . 0.0 110.615 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -59.47 -43.43 93.24 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.42 -0.8 . . . . 0.0 110.199 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.625 HG11 ' CB ' ' A' ' 84' ' ' LEU . 18.9 t -53.12 -25.55 9.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.483 0 O-C-N 121.318 -0.864 . . . . 0.0 109.85 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.0 t -91.2 -35.13 14.7 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 110.059 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -61.61 -53.01 61.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.294 -0.878 . . . . 0.0 110.018 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 5.0 tt0 -60.22 -38.52 83.63 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.332 -0.855 . . . . 0.0 109.254 179.451 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.651 ' SG ' HD11 ' A' ' 85' ' ' ILE . 0.1 OUTLIER -55.77 -30.19 60.88 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.104 -0.998 . . . . 0.0 109.016 179.144 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.53 -23.55 27.66 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.447 -0.783 . . . . 0.0 110.254 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 4.8 pt-20 -80.42 -21.5 42.14 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.189 -0.944 . . . . 0.0 109.635 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.54 41.13 2.9 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.494 -0.754 . . . . 0.0 109.836 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.431 ' HG3' ' N ' ' A' ' 101' ' ' TYR . 0.4 OUTLIER -61.04 -24.85 66.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.353 -0.842 . . . . 0.0 110.255 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.471 ' O ' ' HB ' ' A' ' 105' ' ' THR . 20.6 m-85 -68.67 -27.87 66.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.0 109.673 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 1.011 ' O ' HG22 ' A' ' 105' ' ' THR . . . -75.64 -43.62 46.85 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.439 -0.788 . . . . 0.0 110.062 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.607 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.9 t -71.36 -29.03 33.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.413 -0.804 . . . . 0.0 110.042 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.48 ' HG2' HG21 ' A' ' 131' ' ' VAL . 0.3 OUTLIER -83.56 -28.59 28.47 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.215 -0.928 . . . . 0.0 110.362 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 105' ' ' THR . . . . . 1.011 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.1 t -60.84 -23.51 65.16 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.193 -0.942 . . . . 0.0 110.108 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.979 HD11 HD22 ' A' ' 64' ' ' LEU . 19.0 mt -65.06 -41.95 94.66 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.233 -0.917 . . . . 0.0 109.936 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.492 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 31.2 ttpt -48.09 -28.06 2.67 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.307 -0.871 . . . . 0.0 110.185 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -96.24 -26.7 15.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.366 -0.834 . . . . 0.0 110.259 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.416 ' HB2' ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -55.68 110.64 0.75 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.247 -0.908 . . . . 0.0 110.227 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.439 ' NE2' ' O ' ' A' ' 110' ' ' GLN . 1.1 pp0? -144.32 141.55 29.83 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 110.198 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.492 ' CD2' ' HA3' ' A' ' 68' ' ' GLY . 0.2 OUTLIER -166.88 109.03 0.68 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.234 -0.917 . . . . 0.0 110.143 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.447 ' O ' ' HA3' ' A' ' 116' ' ' GLY . 59.1 t -117.16 -1.69 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.191 -0.943 . . . . 0.0 110.435 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.478 ' OD1' ' CE1' ' A' ' 111' ' ' TYR . 0.6 OUTLIER 53.89 169.85 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.266 -0.896 . . . . 0.0 110.293 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -51.03 -47.96 61.57 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.266 -0.896 . . . . 0.0 110.293 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -117.9 86.51 2.54 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.265 -0.897 . . . . 0.0 110.138 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.447 ' HA3' ' O ' ' A' ' 112' ' ' VAL . . . -136.97 -170.5 11.93 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 24.1 mtmm -112.74 120.22 40.74 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.152 -1.204 . . . . 0.0 110.151 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 59.5 t0 -58.16 101.68 0.09 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.233 -0.917 . . . . 0.0 110.105 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.523 ' CD ' ' CE2' ' A' ' 71' ' ' TRP . 4.7 pp0? -141.81 10.7 2.01 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.317 -0.864 . . . . 0.0 110.325 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.518 ' O ' ' CB ' ' A' ' 124' ' ' ARG . . . -59.8 -14.91 32.16 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.548 HG12 ' N ' ' A' ' 122' ' ' ASN . 32.4 t -66.21 -76.92 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -1.079 . . . . 0.0 111.422 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.548 ' N ' HG12 ' A' ' 121' ' ' VAL . 14.5 m120 -33.01 -55.62 0.39 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.733 -0.604 . . . . 0.0 111.414 -178.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.601 ' CG2' HG12 ' A' ' 74' ' ' VAL . 9.9 p -66.69 -39.7 84.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 120.852 -1.155 . . . . 0.0 109.904 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.518 ' CB ' ' O ' ' A' ' 120' ' ' GLY . 8.9 ttp180 -62.03 -70.9 0.17 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.167 -0.958 . . . . 0.0 110.634 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.403 ' N ' ' HG2' ' A' ' 124' ' ' ARG . 21.8 mt-10 -55.2 -28.67 54.68 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.241 -0.912 . . . . 0.0 110.656 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.498 ' CB ' ' O ' ' A' ' 122' ' ' ASN . 6.1 tptp -62.35 -62.4 1.78 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.092 -1.005 . . . . 0.0 109.578 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.624 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -47.7 -40.87 21.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.356 -0.84 . . . . 0.0 110.004 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.419 ' HG3' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -60.26 -40.31 89.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.215 -0.928 . . . . 0.0 110.381 -179.918 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -54.22 26.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.205 -0.934 . . . . 0.0 110.479 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 1.012 HD21 ' HG2' ' A' ' 81' ' ' MET . 11.7 tp -46.95 -28.98 1.81 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.171 -0.956 . . . . 0.0 109.929 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.48 HG21 ' HG2' ' A' ' 104' ' ' GLN . 28.8 t -79.98 -38.77 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.347 -0.846 . . . . 0.0 109.784 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.81 -47.94 81.16 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.327 -0.858 . . . . 0.0 110.249 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 24.9 tp -54.38 -47.79 72.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.287 -0.883 . . . . 0.0 110.399 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 1.001 HD11 HD13 ' A' ' 85' ' ' ILE . 9.3 mt -78.47 -11.31 59.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.162 -0.961 . . . . 0.0 110.237 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.512 ' CG ' ' O ' ' A' ' 135' ' ' ARG . 6.6 ttm180 -106.19 41.78 1.36 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.231 -0.918 . . . . 0.0 110.222 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.97 -44.89 5.35 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.261 -0.9 . . . . 0.0 110.38 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 50.64 -166.77 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.169 -0.957 . . . . 0.0 110.047 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.412 ' N ' ' OD1' ' A' ' 138' ' ' ASP . 32.1 p-10 -152.45 72.26 0.98 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 110.34 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -84.23 -36.18 22.92 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.323 -0.861 . . . . 0.0 110.24 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -95.6 102.46 14.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.274 -0.891 . . . . 0.0 110.223 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -90.15 42.23 1.09 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.22 -0.925 . . . . 0.0 110.161 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.428 ' O ' ' O ' ' A' ' 143' ' ' GLU . 31.8 tp10 -147.58 -45.65 0.17 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.34 -0.85 . . . . 0.0 110.226 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.428 ' O ' ' O ' ' A' ' 142' ' ' GLU . 0.2 OUTLIER 59.61 115.94 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.241 -0.912 . . . . 0.0 110.221 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.233 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 3.0 m -139.83 112.2 7.74 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.308 -1.113 . . . . 0.0 110.215 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 3.4 p -78.42 113.9 16.84 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.301 -0.874 . . . . 0.0 110.135 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -143.18 -149.51 0.27 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.185 -0.947 . . . . 0.0 110.199 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mmm -81.42 93.48 6.62 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.141 -0.974 . . . . 0.0 110.103 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.9 t -132.06 111.36 11.43 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.213 -0.929 . . . . 0.0 110.203 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.24 -168.14 2.47 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -0.875 . . . . 0.0 110.146 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -130.14 -179.13 5.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.236 -0.915 . . . . 0.0 110.27 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.5 m -131.25 -48.54 1.0 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.25 -0.906 . . . . 0.0 110.133 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.56 169.67 8.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.889 . . . . 0.0 110.239 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -107.97 6.33 27.06 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 110.123 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -115.95 157.84 23.95 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.273 -0.892 . . . . 0.0 110.196 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -58.01 158.31 6.89 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 110.169 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.7 mtt -104.94 -157.88 0.63 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.312 -0.867 . . . . 0.0 110.188 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -78.21 -168.62 1.36 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.244 -0.91 . . . . 0.0 110.151 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.465 ' OD1' ' CD2' ' A' ' 15' ' ' HIS . 1.5 t-20 -136.93 109.28 7.33 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.248 -0.907 . . . . 0.0 110.216 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 1.034 HG22 HG23 ' A' ' 14' ' ' VAL . 2.4 mp -95.41 154.46 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.264 -0.898 . . . . 0.0 110.284 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 1.034 HG23 HG22 ' A' ' 13' ' ' ILE . 5.0 t 41.04 89.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.474 -0.766 . . . . 0.0 110.294 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.465 ' CD2' ' OD1' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -82.93 -158.12 0.26 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.189 -0.945 . . . . 0.0 110.257 -179.914 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -137.89 -84.33 0.31 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.292 -0.88 . . . . 0.0 110.127 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.462 ' CD1' ' C ' ' A' ' 17' ' ' TYR . 14.9 p90 -70.22 165.99 20.98 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 0.0 110.099 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.441 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -156.14 23.68 0.37 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.194 -0.941 . . . . 0.0 110.125 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 18' ' ' SER . 5.6 mt-10 57.07 52.69 8.78 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.331 -0.856 . . . . 0.0 110.163 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.754 ' CA ' HD13 ' A' ' 46' ' ' LEU . . . -53.31 -49.0 67.94 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.275 -0.891 . . . . 0.0 110.117 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.44 ' CG ' ' N ' ' A' ' 22' ' ' ILE . 14.4 pt-20 -44.06 -37.58 3.1 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.992 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.44 ' N ' ' CG ' ' A' ' 21' ' ' GLU . 29.3 mm -72.07 -42.63 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.322 -0.861 . . . . 0.0 110.074 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.597 ' O ' HD11 ' A' ' 39' ' ' LEU . 29.0 mmtt -56.41 -32.75 65.14 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.178 -0.951 . . . . 0.0 110.226 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.566 HG21 ' HA ' ' A' ' 56' ' ' ILE . 90.1 t -76.75 -37.46 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.294 -0.879 . . . . 0.0 110.191 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.3 -37.89 75.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.171 -0.956 . . . . 0.0 110.24 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -82.83 -48.85 10.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.328 -0.857 . . . . 0.0 110.164 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 1.087 ' HB2' HD12 ' A' ' 39' ' ' LEU . . . -44.6 -47.78 10.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.9 . . . . 0.0 110.17 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.48 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 4.8 p -68.57 -54.7 14.96 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.346 -0.846 . . . . 0.0 110.183 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.91 -171.79 2.42 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.304 -0.872 . . . . 0.0 110.271 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -126.86 136.39 52.27 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.277 -0.889 . . . . 0.0 110.207 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -131.77 149.15 72.62 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.206 -0.934 . . . . 0.0 110.274 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -65.64 -177.53 0.74 Allowed 'Trans proline' 0 C--N 1.305 -1.712 0 O-C-N 124.04 1.547 . . . . 0.0 110.406 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER 60.5 -152.9 0.38 Allowed 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.213 -0.93 . . . . 0.0 110.465 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.23 67.68 1.12 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -66.22 -35.7 31.45 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.963 1.507 . . . . 0.0 110.425 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.61 -178.01 3.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.181 -0.949 . . . . 0.0 110.259 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.6 t -119.77 123.71 44.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.257 -0.902 . . . . 0.0 110.255 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.2 49.84 0.4 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.231 -0.918 . . . . 0.0 110.058 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 1.087 HD12 ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER -121.12 -20.77 6.67 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.281 -0.887 . . . . 0.0 110.229 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -90.28 -59.38 2.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.281 -0.887 . . . . 0.0 110.203 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.07 -12.44 61.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.301 -0.874 . . . . 0.0 110.228 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -83.98 -66.01 0.94 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.292 -0.88 . . . . 0.0 110.336 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.598 HG21 HD11 ' A' ' 80' ' ' LEU . 79.8 mt -46.24 -38.1 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.217 -0.927 . . . . 0.0 110.094 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.752 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -68.11 -52.01 39.83 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.184 -0.948 . . . . 0.0 109.387 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.526 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 19.7 t0 -53.61 -20.84 5.68 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.064 -1.022 . . . . 0.0 108.912 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.754 HD13 ' CA ' ' A' ' 20' ' ' ALA . 13.4 mt -81.56 -36.41 29.11 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.578 -0.702 . . . . 0.0 110.06 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.528 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 73.1 p -52.19 -40.92 62.18 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.08 -1.013 . . . . 0.0 109.157 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.558 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 79.6 m-85 -43.22 -43.87 4.96 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 119.556 -0.857 . . . . 0.0 109.394 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 51' ' ' VAL . 1.2 t-20 -73.72 91.31 1.89 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.62 -0.675 . . . . 0.0 110.45 179.454 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -11.56 -56.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.696 178.183 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.548 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.7 t -63.97 -65.85 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 120.972 -1.08 . . . . 0.0 110.197 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -39.33 -41.96 0.98 Allowed 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 121.241 0.543 . . . . 0.0 110.633 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.577 ' CE1' ' HA ' ' A' ' 92' ' ' VAL . 4.2 t80 -62.1 -57.57 11.09 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.458 -0.776 . . . . 0.0 110.546 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 58' ' ' SER . 0.4 OUTLIER -55.17 -24.7 28.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.21 -0.931 . . . . 0.0 110.418 -179.458 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -87.87 -25.0 23.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.247 -0.908 . . . . 0.0 110.272 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.61 HD11 ' HB3' ' A' ' 46' ' ' LEU . 19.7 mt -74.75 -70.28 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.369 -0.832 . . . . 0.0 110.426 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.465 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 4.2 mtp -45.82 -37.94 6.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.22 -0.925 . . . . 0.0 110.097 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 54' ' ' SER . 0.4 OUTLIER -53.22 -59.02 5.09 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.191 -0.943 . . . . 0.0 109.861 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -27.74 67.83 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.181 -0.949 . . . . 0.0 109.585 179.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.881 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -68.82 -29.05 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.425 -0.797 . . . . 0.0 109.705 179.539 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.418 ' CD1' ' O ' ' A' ' 57' ' ' MET . 20.9 m95 -79.08 -37.18 39.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.189 -0.944 . . . . 0.0 110.229 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -62.86 -56.76 14.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.255 -0.903 . . . . 0.0 110.314 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.43 -26.26 68.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.212 -0.93 . . . . 0.0 110.252 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.811 HD11 ' CE ' ' A' ' 81' ' ' MET . 8.4 mt -64.51 -15.43 60.85 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.287 -0.883 . . . . 0.0 110.354 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.479 ' O ' ' O ' ' A' ' 66' ' ' ASP . 1.6 m120 -110.89 41.27 1.84 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.249 -0.907 . . . . 0.0 110.354 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.605 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.5 OUTLIER -55.2 -163.0 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.338 -0.851 . . . . 0.0 110.088 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.402 ' O ' ' C ' ' A' ' 68' ' ' GLY . 0.1 OUTLIER -156.97 -170.2 3.21 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.024 -1.048 . . . . 0.0 110.671 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.402 ' C ' ' O ' ' A' ' 67' ' ' HIS . . . 45.19 -141.73 4.06 Favored Glycine 0 N--CA 1.484 1.891 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -99.61 14.92 28.33 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.495 -1.003 . . . . 0.0 109.922 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -89.67 28.37 1.33 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.259 -0.9 . . . . 0.0 110.195 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.485 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 26.0 p-90 -59.92 -15.8 24.6 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 110.067 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.485 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 4.2 tpt180 -43.47 -43.4 5.35 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.27 -0.894 . . . . 0.0 110.097 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 39.3 m170 -56.86 -47.28 80.77 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.246 -0.909 . . . . 0.0 110.063 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.8 HG11 HD22 ' A' ' 106' ' ' LEU . 59.4 t -51.87 -49.57 36.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.287 -0.883 . . . . 0.0 109.925 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.508 ' CE1' ' HG2' ' A' ' 126' ' ' LYS . 10.0 t80 -51.41 -59.84 3.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.191 -0.943 . . . . 0.0 109.925 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.48 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 8.6 mmtt -52.1 -27.0 12.52 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.905 . . . . 0.0 109.779 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.676 ' HB3' ' O ' ' A' ' 74' ' ' VAL . . . -68.31 -54.36 17.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.376 -0.827 . . . . 0.0 110.232 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.762 ' HE1' HG12 ' A' ' 74' ' ' VAL . 2.3 mpp? -47.09 -38.13 10.82 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.382 -0.823 . . . . 0.0 110.34 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.6 m -67.18 -38.77 85.95 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.165 -0.959 . . . . 0.0 110.212 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.881 ' CD2' HD11 ' A' ' 60' ' ' ILE . 16.7 tp -65.85 -64.58 0.83 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.224 -0.922 . . . . 0.0 109.138 179.119 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.811 ' CE ' HD11 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -51.86 -27.15 11.72 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.268 -0.895 . . . . 0.0 110.331 179.536 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.652 ' HB2' HD22 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -75.84 -35.47 59.96 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.006 -1.059 . . . . 0.0 110.035 179.629 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.579 ' CE2' HG21 ' A' ' 87' ' ' THR . 33.8 t80 -75.81 -58.21 3.42 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.403 -0.811 . . . . 0.0 110.58 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.572 ' HB2' HG11 ' A' ' 92' ' ' VAL . 5.3 mt -46.72 -48.49 20.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.169 -0.957 . . . . 0.0 109.83 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.044 HD13 HD21 ' A' ' 134' ' ' LEU . 63.1 mt -48.23 -43.05 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.107 -0.996 . . . . 0.0 110.322 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.3 tttp -75.55 -78.0 0.12 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.251 -0.906 . . . . 0.0 110.717 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.579 HG21 ' CE2' ' A' ' 83' ' ' TYR . 7.8 t -86.01 -25.61 25.87 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.159 -0.963 . . . . 0.0 110.764 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.752 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -43.48 -80.13 0.05 OUTLIER Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.4 t -172.25 161.6 5.38 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.175 -1.191 . . . . 0.0 110.194 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.4 -27.04 68.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.206 -0.934 . . . . 0.0 110.186 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.431 ' HG3' ' CD2' ' A' ' 53' ' ' PHE . 9.9 ptp180 -72.75 -34.67 67.18 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.197 -0.939 . . . . 0.0 109.852 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.577 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 54.0 t -58.4 -51.63 69.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.284 -0.885 . . . . 0.0 109.942 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.3 t -58.46 -41.36 85.02 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.177 -0.952 . . . . 0.0 109.71 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -57.95 -40.07 79.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.226 -0.921 . . . . 0.0 109.795 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.527 ' HA ' ' HG2' ' A' ' 98' ' ' GLU . 6.4 tp-100 -67.53 -39.37 85.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.315 -0.866 . . . . 0.0 109.397 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.62 ' SG ' HD11 ' A' ' 85' ' ' ILE . 2.7 t -56.59 -31.95 64.76 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.221 -0.924 . . . . 0.0 108.831 179.044 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.446 ' HA ' ' SD ' ' A' ' 100' ' ' MET . 0.8 OUTLIER -81.42 -24.92 36.58 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.512 -0.742 . . . . 0.0 109.771 179.333 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.527 ' HG2' ' HA ' ' A' ' 95' ' ' GLN . 0.1 OUTLIER -77.94 -22.84 48.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.245 -0.909 . . . . 0.0 109.743 179.736 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.502 ' N ' ' HG3' ' A' ' 98' ' ' GLU . 8.4 t30 -132.19 38.53 3.48 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.555 -0.716 . . . . 0.0 109.797 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.446 ' SD ' ' HA ' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -60.53 -34.72 74.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.834 . . . . 0.0 109.908 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.456 ' O ' ' HB ' ' A' ' 105' ' ' THR . 66.3 m-85 -57.08 -27.96 62.18 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.301 -0.874 . . . . 0.0 109.688 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 1.005 ' O ' HG22 ' A' ' 105' ' ' THR . . . -71.93 -42.86 66.15 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.459 -0.775 . . . . 0.0 110.077 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.658 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 6.2 t -68.81 -28.16 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.702 ' HG2' HG21 ' A' ' 131' ' ' VAL . 1.2 mm100 -90.37 -20.66 22.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.915 . . . . 0.0 110.449 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' THR . . . . . 1.005 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.2 t -61.32 -22.44 64.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.198 -0.939 . . . . 0.0 110.24 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.8 HD22 HG11 ' A' ' 74' ' ' VAL . 35.3 mt -61.44 -39.12 89.65 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 110.204 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 124' ' ' ARG . 0.2 OUTLIER -44.14 -31.06 0.86 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.209 -0.932 . . . . 0.0 110.146 179.894 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.49 -38.55 14.89 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.265 -0.897 . . . . 0.0 110.259 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -49.14 113.19 0.75 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.259 -0.901 . . . . 0.0 110.284 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.0 147.6 31.83 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.227 -0.921 . . . . 0.0 110.195 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -159.4 127.18 4.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.297 -0.877 . . . . 0.0 110.307 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.572 HG13 ' N ' ' A' ' 117' ' ' LYS . 52.1 t -128.67 -2.24 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.251 -0.906 . . . . 0.0 110.192 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.47 ' O ' ' O ' ' A' ' 112' ' ' VAL . 1.3 m-20 45.69 -172.74 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.104 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.418 ' HG3' ' OD1' ' A' ' 115' ' ' ASP . 1.0 OUTLIER -51.11 -47.75 61.87 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.188 -0.945 . . . . 0.0 110.066 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.418 ' OD1' ' HG3' ' A' ' 114' ' ' ARG . 8.1 p-10 -130.39 125.36 34.35 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.416 -0.803 . . . . 0.0 110.109 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.455 ' O ' ' OE1' ' A' ' 119' ' ' GLN . . . -174.77 -33.22 0.04 OUTLIER Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.572 ' N ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER 67.39 142.5 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.32 -1.106 . . . . 0.0 110.37 179.871 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -54.03 108.67 0.38 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.266 -0.896 . . . . 0.0 110.172 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.455 ' OE1' ' O ' ' A' ' 116' ' ' GLY . 10.9 pt20 -149.53 16.0 0.89 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.198 -0.939 . . . . 0.0 110.142 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -101.6 34.35 5.75 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.552 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p -80.11 -41.96 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -1.164 . . . . 0.0 110.148 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.552 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.4 m120 -37.72 -28.31 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.816 -0.552 . . . . 0.0 110.804 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' A' ' 121' ' ' VAL . 3.8 t -81.72 -58.72 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.188 -0.945 . . . . 0.0 110.382 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.484 ' HB2' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -50.62 -30.96 14.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.222 -0.924 . . . . 0.0 110.799 -179.476 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.508 ' HG3' HG22 ' A' ' 121' ' ' VAL . 3.3 mt-10 -81.45 -53.76 6.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.221 -0.925 . . . . 0.0 111.169 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.508 ' HG2' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -51.64 -47.12 63.85 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.081 -1.012 . . . . 0.0 110.593 -179.465 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.658 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -67.65 -41.55 83.63 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.3 -0.875 . . . . 0.0 111.003 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 124' ' ' ARG . 0.2 OUTLIER -58.53 -43.84 89.37 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.074 -1.016 . . . . 0.0 110.884 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.452 ' OE1' ' N ' ' A' ' 129' ' ' GLN . 0.5 OUTLIER -64.94 -49.44 70.36 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.086 -1.009 . . . . 0.0 110.803 -179.519 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.652 HD22 ' HB2' ' A' ' 82' ' ' GLU . 12.1 tp -51.26 -41.69 60.55 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.062 -1.024 . . . . 0.0 110.258 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.702 HG21 ' HG2' ' A' ' 104' ' ' GLN . 25.3 t -66.3 -32.77 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.252 -0.905 . . . . 0.0 109.878 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.9 -51.71 56.32 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.145 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.43 ' O ' ' C ' ' A' ' 134' ' ' LEU . 0.5 OUTLIER -61.69 -42.07 98.43 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.323 -0.86 . . . . 0.0 110.446 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 1.044 HD21 HD13 ' A' ' 85' ' ' ILE . 1.5 mm? -42.46 -64.48 0.6 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.309 -0.87 . . . . 0.0 110.299 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 15.6 ttp85 -114.08 63.67 0.66 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.288 -0.882 . . . . 0.0 110.201 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -76.08 -47.79 23.24 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.262 -0.899 . . . . 0.0 110.24 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -174.98 -171.63 0.54 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.194 -0.941 . . . . 0.0 110.232 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.414 ' N ' ' OD1' ' A' ' 138' ' ' ASP . 3.4 m-20 -105.34 61.16 0.68 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.286 -0.884 . . . . 0.0 110.157 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -101.75 -31.29 10.84 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.18 -0.95 . . . . 0.0 110.262 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.493 HD11 ' HB3' ' A' ' 143' ' ' GLU . 0.1 OUTLIER -111.58 105.88 14.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.214 -0.929 . . . . 0.0 110.287 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -114.01 -36.59 4.71 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.218 -0.926 . . . . 0.0 110.253 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -156.39 83.89 0.98 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 110.245 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.493 ' HB3' HD11 ' A' ' 140' ' ' LEU . 0.4 OUTLIER -149.56 52.23 0.94 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.196 -0.94 . . . . 0.0 110.16 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.433 ' O ' ' O ' ' A' ' 143' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.095 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.35 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 4.0 p -145.84 19.96 1.46 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.151 -1.205 . . . . 0.0 110.259 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 58.0 177.46 0.06 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.145 -0.972 . . . . 0.0 110.205 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -73.58 169.34 17.46 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.252 -0.905 . . . . 0.0 110.315 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 ptp -148.59 170.9 17.07 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.312 -0.867 . . . . 0.0 110.192 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 t -68.5 120.57 14.76 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.215 -0.928 . . . . 0.0 110.196 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 8.8 t -157.33 46.4 0.39 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.206 -0.934 . . . . 0.0 110.212 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.6 m -160.15 147.34 16.23 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.264 -0.898 . . . . 0.0 110.121 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 71.0 m -89.36 170.59 10.42 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.232 -0.917 . . . . 0.0 110.161 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.06 132.25 46.82 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.325 -0.859 . . . . 0.0 110.203 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.414 ' C ' ' HG2' ' A' ' 8' ' ' ARG . 3.6 mmt-85 -44.54 -90.66 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.27 -0.894 . . . . 0.0 110.158 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 9' ' ' GLN . 6.6 mmt180 -130.74 -143.26 0.24 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.118 -0.989 . . . . 0.0 110.153 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.416 ' C ' ' O ' ' A' ' 8' ' ' ARG . 2.8 mm-40 -42.91 148.55 0.24 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.231 -0.918 . . . . 0.0 110.234 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 11.0 ptt? -66.36 -169.65 0.08 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -83.43 -166.41 1.36 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.296 -0.878 . . . . 0.0 110.178 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -103.32 104.9 15.06 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.274 -0.891 . . . . 0.0 110.149 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 15.4 mm -103.52 160.69 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.272 -0.892 . . . . 0.0 110.286 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.6 m -47.77 115.02 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.23 -0.919 . . . . 0.0 110.262 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -83.52 72.15 10.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.219 -0.926 . . . . 0.0 110.225 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -93.02 -172.14 2.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.128 -0.983 . . . . 0.0 110.167 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.456 ' O ' ' CB ' ' A' ' 18' ' ' SER . 3.7 m-85 -78.47 168.47 19.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.216 -0.927 . . . . 0.0 110.175 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.456 ' CB ' ' O ' ' A' ' 17' ' ' TYR . 0.3 OUTLIER 172.3 -66.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.228 -0.92 . . . . 0.0 110.207 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 18' ' ' SER . 59.8 mt-10 57.25 16.55 3.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.238 -0.914 . . . . 0.0 110.385 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.481 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -58.91 -47.22 85.78 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.297 -0.877 . . . . 0.0 110.182 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.425 ' HG3' HG12 ' A' ' 22' ' ' ILE . 10.4 pt-20 -45.22 -30.95 1.33 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.275 -0.891 . . . . 0.0 109.991 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.425 HG12 ' HG3' ' A' ' 21' ' ' GLU . 27.9 mm -75.5 -44.74 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.345 -0.847 . . . . 0.0 110.038 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.483 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 2.9 mmtp -55.53 -51.88 65.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.244 -0.91 . . . . 0.0 110.003 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.833 HG21 ' HA ' ' A' ' 56' ' ' ILE . 98.7 t -58.57 -37.63 66.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.224 -0.923 . . . . 0.0 110.064 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -69.05 0.13 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.253 -0.904 . . . . 0.0 109.977 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -64.08 -13.64 48.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.423 -0.798 . . . . 0.0 110.199 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.863 ' HB2' HD12 ' A' ' 39' ' ' LEU . . . -77.0 -30.3 55.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.249 -0.907 . . . . 0.0 110.082 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.492 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 32.7 p -99.74 34.23 2.32 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.304 -0.872 . . . . 0.0 110.031 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.8 p -172.11 125.99 0.55 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.254 -0.904 . . . . 0.0 109.945 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -151.9 150.71 30.37 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.161 -0.962 . . . . 0.0 110.453 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.596 ' CB ' ' CD ' ' A' ' 32' ' ' PRO . 0.8 OUTLIER -175.27 -61.54 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.339 -0.851 . . . . 0.0 110.002 179.82 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.596 ' CD ' ' CB ' ' A' ' 31' ' ' ASP . 29.4 Cg_endo -69.12 168.66 20.07 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 O-C-N 123.927 1.488 . . . . 0.0 110.174 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.416 ' O ' ' O ' ' A' ' 32' ' ' PRO . 0.5 OUTLIER 53.07 172.99 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.265 -0.897 . . . . 0.0 110.661 179.816 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.407 ' HA3' ' HD2' ' A' ' 35' ' ' PRO . . . -79.98 -142.65 2.84 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.407 ' HD2' ' HA3' ' A' ' 34' ' ' GLY . 18.9 Cg_endo -66.09 -175.36 0.49 Allowed 'Trans proline' 0 C--N 1.306 -1.71 0 O-C-N 124.026 1.54 . . . . 0.0 110.39 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.58 -177.44 3.36 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.263 -0.898 . . . . 0.0 110.229 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.5 m -110.38 -77.22 0.6 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.267 -0.896 . . . . 0.0 110.209 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.45 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.3 m -130.71 76.2 1.71 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.238 -0.914 . . . . 0.0 110.247 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.863 HD12 ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -102.73 -47.92 4.26 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.915 . . . . 0.0 110.247 179.949 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.35 -53.75 9.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.268 -0.895 . . . . 0.0 110.235 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.3 t -56.75 -27.46 59.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.198 -0.939 . . . . 0.0 110.207 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 38' ' ' SER . 0.0 OUTLIER -78.16 -50.19 12.43 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.3 -0.875 . . . . 0.0 110.233 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.732 HG21 HD11 ' A' ' 80' ' ' LEU . 82.1 mt -56.31 -36.48 46.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.201 -0.937 . . . . 0.0 110.012 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.638 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -67.65 -49.85 60.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.303 -0.873 . . . . 0.0 109.654 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.482 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 25.8 t70 -55.31 -18.86 7.12 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.124 -0.985 . . . . 0.0 109.141 179.129 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.507 ' HB3' ' HB1' ' A' ' 52' ' ' ALA . 10.7 mt -85.32 -34.22 21.91 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.529 -0.732 . . . . 0.0 110.119 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.525 HG21 HG21 ' A' ' 92' ' ' VAL . 76.1 p -56.23 -41.08 75.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.153 -0.967 . . . . 0.0 109.521 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.582 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 85.4 m-85 -43.3 -43.69 5.06 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 119.776 -0.77 . . . . 0.0 109.195 179.466 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.479 ' HB2' ' O ' ' A' ' 46' ' ' LEU . 5.6 m-20 -58.87 -160.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.662 0.744 . . . . 0.0 110.051 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 m -122.01 -32.35 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.547 HG12 ' N ' ' A' ' 52' ' ' ALA . 10.6 t -85.64 -70.86 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 CA-C-O 121.947 0.88 . . . . 0.0 109.806 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.567 ' O ' HD12 ' A' ' 56' ' ' ILE . . . -38.31 -40.38 0.52 Allowed 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.787 -177.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.669 ' CE1' HG22 ' A' ' 92' ' ' VAL . 7.4 t80 -55.39 -58.86 6.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.257 -0.902 . . . . 0.0 110.291 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 58' ' ' SER . 67.3 m -55.62 -41.08 72.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.18 -0.95 . . . . 0.0 110.086 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.6 -25.08 67.24 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.359 -0.838 . . . . 0.0 109.971 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.833 ' HA ' HG21 ' A' ' 24' ' ' VAL . 10.8 mt -79.33 -70.4 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.404 -0.81 . . . . 0.0 110.144 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.445 ' HA ' ' HB ' ' A' ' 60' ' ' ILE . 15.3 mtp -47.96 -39.82 20.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.192 -0.943 . . . . 0.0 109.596 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.447 ' HB2' ' O ' ' A' ' 54' ' ' SER . 38.5 t -53.42 -57.29 11.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.325 -0.86 . . . . 0.0 109.762 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.445 ' HB2' HG11 ' A' ' 24' ' ' VAL . 8.8 mmt -62.17 -23.17 66.44 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.232 -0.918 . . . . 0.0 109.596 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.69 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -72.42 -31.74 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.405 -0.81 . . . . 0.0 109.29 179.524 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -74.7 -44.99 47.29 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.352 -0.842 . . . . 0.0 109.722 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.59 -52.93 61.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.254 -0.904 . . . . 0.0 109.705 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 14.5 mmp_? -62.7 -35.79 80.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.229 -0.92 . . . . 0.0 109.713 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 1.031 ' O ' HG22 ' A' ' 74' ' ' VAL . 4.1 mt -54.4 -24.02 18.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.351 -0.843 . . . . 0.0 110.052 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -122.02 48.82 1.65 Allowed 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.469 -0.769 . . . . 0.0 109.141 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.519 ' HB2' ' HB3' ' A' ' 73' ' ' HIS . 0.7 OUTLIER -82.71 165.34 20.03 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.475 -0.766 . . . . 0.0 110.855 -178.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.462 ' O ' ' O ' ' A' ' 66' ' ' ASP . 22.2 m170 54.13 165.18 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.691 -0.631 . . . . 0.0 110.362 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.574 ' O ' ' CE1' ' A' ' 109' ' ' PHE . . . -58.47 -95.83 0.01 OUTLIER Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.577 ' HA ' ' CE1' ' A' ' 109' ' ' PHE . 27.3 ttmt -104.71 20.85 17.92 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.708 -0.878 . . . . 0.0 110.457 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.549 ' HA ' ' HB2' ' A' ' 111' ' ' TYR . 1.4 t-20 -76.8 146.97 37.5 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.491 -0.755 . . . . 0.0 110.741 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.59 ' CD1' ' HA2' ' A' ' 120' ' ' GLY . 58.4 p-90 -110.55 18.2 19.98 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.424 -0.798 . . . . 0.0 110.468 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.0 mmt180 -71.44 -70.35 0.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.188 -0.945 . . . . 0.0 110.492 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.519 ' HB3' ' HB2' ' A' ' 66' ' ' ASP . 0.2 OUTLIER -55.98 -49.46 73.52 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.214 -0.929 . . . . 0.0 110.138 -179.851 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 1.031 HG22 ' O ' ' A' ' 64' ' ' LEU . 68.8 t -44.0 -53.01 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.434 -0.791 . . . . 0.0 110.488 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.511 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 5.3 t80 -49.68 -56.27 10.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.273 -0.892 . . . . 0.0 110.196 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.492 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -56.59 -28.53 60.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.201 -0.937 . . . . 0.0 110.144 179.945 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.886 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -71.14 -34.92 71.48 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.361 -0.837 . . . . 0.0 109.81 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.838 ' HE1' HG22 ' A' ' 123' ' ' VAL . 0.6 OUTLIER -61.8 -38.9 89.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.472 -0.768 . . . . 0.0 109.715 179.52 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 40.9 m -61.04 -63.91 1.13 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.278 -0.889 . . . . 0.0 110.058 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.749 HD21 HG22 ' A' ' 24' ' ' VAL . 20.1 tp -47.35 -54.1 12.03 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.212 -0.93 . . . . 0.0 110.068 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.873 ' HG2' HD22 ' A' ' 130' ' ' LEU . 3.7 ttp -50.76 -37.25 40.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.193 -0.942 . . . . 0.0 110.365 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.538 ' HA ' HD21 ' A' ' 130' ' ' LEU . 26.2 tt0 -74.17 -68.58 0.51 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.096 -1.003 . . . . 0.0 110.574 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.565 ' CE2' HG21 ' A' ' 87' ' ' THR . 55.0 t80 -37.58 -45.91 0.8 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.494 -0.754 . . . . 0.0 111.367 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.558 ' CB ' HG11 ' A' ' 92' ' ' VAL . 75.6 mt -66.68 -42.31 86.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.14 -0.975 . . . . 0.0 110.695 -179.243 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.909 HD13 HD11 ' A' ' 134' ' ' LEU . 32.3 mt -52.73 -19.91 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 120.933 -1.104 . . . . 0.0 110.158 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.82 -87.96 0.44 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.297 -0.877 . . . . 0.0 110.293 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.565 HG21 ' CE2' ' A' ' 83' ' ' TYR . 14.9 t -69.41 -6.21 28.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.224 -0.922 . . . . 0.0 110.222 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.638 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -72.19 -78.74 0.48 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.3 t -174.81 157.01 2.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.11 -1.229 . . . . 0.0 110.234 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.92 -21.84 65.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.302 -0.874 . . . . 0.0 110.191 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.28 -39.5 59.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.22 -0.925 . . . . 0.0 110.08 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.669 HG22 ' CE1' ' A' ' 53' ' ' PHE . 78.4 t -58.69 -31.48 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.289 -0.882 . . . . 0.0 110.074 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 29.6 p -79.06 -38.69 35.79 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.159 -0.963 . . . . 0.0 110.018 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -59.67 -59.37 5.55 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.283 -0.885 . . . . 0.0 109.832 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.42 -35.85 63.37 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.481 -0.762 . . . . 0.0 109.8 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.562 ' HB3' HD13 ' A' ' 134' ' ' LEU . 11.6 m -60.91 -36.38 79.12 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.19 -0.944 . . . . 0.0 109.713 179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.498 ' HG3' ' HG2' ' A' ' 135' ' ' ARG . 29.9 ttpt -73.83 -26.63 60.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.403 -0.811 . . . . 0.0 109.589 179.533 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -81.85 -22.84 36.76 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.373 -0.829 . . . . 0.0 110.057 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -111.52 34.75 3.95 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.286 -0.884 . . . . 0.0 110.34 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.6 ptp -60.97 -31.06 70.65 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.215 -0.928 . . . . 0.0 110.17 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -61.42 -26.27 67.75 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.888 . . . . 0.0 110.2 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 1.022 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.65 -40.75 48.15 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.244 -0.91 . . . . 0.0 110.15 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.573 HG22 ' HE1' ' A' ' 81' ' ' MET . 5.3 t -72.12 -27.46 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.376 -0.828 . . . . 0.0 110.151 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.73 ' NE2' HG11 ' A' ' 131' ' ' VAL . 15.5 mm-40 -82.18 -26.89 32.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.174 -0.954 . . . . 0.0 110.315 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' THR . . . . . 1.022 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.1 t -64.85 -12.64 50.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.128 -0.983 . . . . 0.0 110.04 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 1.002 HD11 HD22 ' A' ' 64' ' ' LEU . 65.4 mt -77.23 -33.17 56.18 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.274 -0.891 . . . . 0.0 110.181 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.536 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 1.2 ttmt -41.41 -27.47 0.09 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.378 -0.827 . . . . 0.0 110.464 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.435 ' N ' ' O ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -90.03 -37.91 13.97 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.257 -0.902 . . . . 0.0 110.276 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.577 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -41.62 100.88 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.3 -0.875 . . . . 0.0 110.58 -179.847 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.457 ' CG ' ' O ' ' A' ' 110' ' ' GLN . 6.0 pt20 -153.0 84.16 1.21 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.329 -0.857 . . . . 0.0 110.353 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.549 ' HB2' ' HA ' ' A' ' 70' ' ' ASN . 0.5 OUTLIER -77.33 124.54 28.0 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.2 -0.937 . . . . 0.0 109.85 179.814 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.69 HG22 ' N ' ' A' ' 117' ' ' LYS . 3.4 p -113.23 -11.7 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.118 -0.988 . . . . 0.0 110.589 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.529 ' CB ' ' OD1' ' A' ' 115' ' ' ASP . 1.2 m-20 55.58 -178.37 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.371 -0.831 . . . . 0.0 110.572 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.502 ' HD2' ' N ' ' A' ' 115' ' ' ASP . 5.0 ppt_? -55.42 -45.19 76.76 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.32 -0.863 . . . . 0.0 110.913 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.529 ' OD1' ' CB ' ' A' ' 113' ' ' ASP . 5.2 p-10 -38.99 -28.24 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.401 -0.812 . . . . 0.0 110.741 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 114' ' ' ARG . . . 63.09 39.6 98.2 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.69 ' N ' HG22 ' A' ' 112' ' ' VAL . 2.2 mmtt -107.07 97.58 7.34 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.324 -1.103 . . . . 0.0 110.177 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -56.2 114.02 1.8 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.202 -0.936 . . . . 0.0 110.167 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.423 ' OE1' ' HB3' ' A' ' 117' ' ' LYS . 10.9 pt20 -152.64 27.23 0.56 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.256 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.59 ' HA2' ' CD1' ' A' ' 71' ' ' TRP . . . -111.71 62.82 0.29 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.542 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 2.8 p -113.14 -41.47 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 O-C-N 121.245 -1.15 . . . . 0.0 110.146 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.542 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.6 m120 -36.13 -31.2 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.833 -0.542 . . . . 0.0 110.775 -179.669 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.838 HG22 ' HE1' ' A' ' 78' ' ' MET . 1.0 OUTLIER -82.19 -46.07 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.263 -0.898 . . . . 0.0 109.917 179.783 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.536 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -57.35 -30.88 65.2 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.203 -0.936 . . . . 0.0 110.61 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.457 ' OE1' HG13 ' A' ' 121' ' ' VAL . 44.8 mt-10 -82.71 -54.75 4.89 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.196 -0.94 . . . . 0.0 111.055 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.511 ' HG3' ' CE1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -52.62 -49.64 64.71 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.096 -1.002 . . . . 0.0 110.235 -179.631 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.523 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -61.14 -41.62 97.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.314 -0.866 . . . . 0.0 110.431 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 124' ' ' ARG . 2.4 ttmt -56.9 -49.66 74.91 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.161 -0.962 . . . . 0.0 110.369 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -55.2 -49.59 71.54 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 110.379 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.873 HD22 ' HG2' ' A' ' 81' ' ' MET . 0.3 OUTLIER -53.29 -40.82 65.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.161 -0.962 . . . . 0.0 110.161 -179.916 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.73 HG11 ' NE2' ' A' ' 104' ' ' GLN . 26.4 t -72.75 -25.91 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.356 -0.84 . . . . 0.0 110.191 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.45 ' O ' ' OD1' ' A' ' 136' ' ' ASP . . . -70.23 -56.17 7.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.218 -0.926 . . . . 0.0 110.389 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 15.7 tp -69.9 -37.8 76.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.289 -0.882 . . . . 0.0 110.377 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.909 HD11 HD13 ' A' ' 85' ' ' ILE . 30.9 mt -70.83 -68.07 0.46 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.154 -0.966 . . . . 0.0 110.206 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.498 ' HG2' ' HG3' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -92.84 113.17 25.38 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.15 -0.969 . . . . 0.0 110.187 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.45 ' OD1' ' O ' ' A' ' 132' ' ' ALA . 0.4 OUTLIER -144.16 -66.44 0.35 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.243 -0.911 . . . . 0.0 110.352 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -167.6 64.8 0.08 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 110.281 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.87 118.98 4.4 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.25 -0.906 . . . . 0.0 110.376 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -96.17 -158.48 0.66 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 110.175 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.441 ' O ' ' O ' ' A' ' 141' ' ' ARG . 0.9 OUTLIER -169.87 151.99 4.32 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.242 -0.912 . . . . 0.0 110.272 179.855 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.441 ' O ' ' O ' ' A' ' 140' ' ' LEU . 0.5 OUTLIER -56.36 -162.44 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.206 -0.934 . . . . 0.0 110.339 -179.846 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 141' ' ' ARG . 2.3 tm-20 63.81 19.25 11.64 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 110.17 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -159.39 -168.65 2.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.304 -0.873 . . . . 0.0 110.25 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.219 179.949 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 1.9 m -99.71 171.89 7.62 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -1.131 . . . . 0.0 110.303 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.84 88.36 2.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.289 -0.882 . . . . 0.0 110.177 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -85.94 173.57 9.86 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.229 -0.92 . . . . 0.0 110.246 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.47 134.74 49.81 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.248 -0.908 . . . . 0.0 110.131 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 m 60.45 59.27 2.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.307 -0.871 . . . . 0.0 110.255 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.403 ' O ' ' C ' ' A' ' 4' ' ' SER . 1.7 m -110.67 144.31 39.8 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.884 . . . . 0.0 110.275 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.403 ' C ' ' O ' ' A' ' 3' ' ' THR . 94.7 p 44.15 51.38 7.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.284 -0.885 . . . . 0.0 110.168 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.455 ' O ' ' O ' ' A' ' 6' ' ' LEU . 9.4 t -73.15 -45.14 58.4 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -0.931 . . . . 0.0 110.139 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' A' ' 5' ' ' SER . 0.2 OUTLIER 51.76 102.78 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.31 -0.869 . . . . 0.0 110.313 179.968 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -85.84 -165.4 1.23 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.328 -0.857 . . . . 0.0 110.193 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -99.24 153.35 19.01 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.186 -0.946 . . . . 0.0 110.096 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 98.4 mm-40 -90.75 148.89 22.27 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.244 -0.91 . . . . 0.0 110.253 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 99.3 mmm -126.12 -74.29 0.6 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.295 -0.878 . . . . 0.0 110.179 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.0 pttt -47.6 -48.77 28.1 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.24 -0.913 . . . . 0.0 110.499 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 59.4 106.68 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 110.073 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.0 mp -92.32 137.56 21.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.294 -0.879 . . . . 0.0 110.376 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.5 t -104.83 65.16 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.316 -0.865 . . . . 0.0 110.179 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -98.21 -166.24 1.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.251 -0.906 . . . . 0.0 110.306 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.466 ' HB3' ' CB ' ' A' ' 19' ' ' GLU . 25.5 m-20 -83.14 115.98 22.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.244 -0.91 . . . . 0.0 110.222 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -87.65 159.77 18.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.282 -0.886 . . . . 0.0 110.175 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 70.5 m 45.78 27.14 0.43 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -0.93 . . . . 0.0 110.072 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.466 ' CB ' ' HB3' ' A' ' 16' ' ' ASN . 3.4 mt-10 -110.76 -25.11 10.08 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.21 -0.931 . . . . 0.0 110.182 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.953 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -65.01 -52.97 53.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.233 -0.917 . . . . 0.0 110.15 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.409 ' CG ' ' N ' ' A' ' 22' ' ' ILE . 12.5 pt-20 -50.1 -34.1 20.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.236 -0.915 . . . . 0.0 110.053 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.409 ' N ' ' CG ' ' A' ' 21' ' ' GLU . 13.4 mt -66.07 -39.41 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.255 -0.903 . . . . 0.0 109.934 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.457 ' CB ' HG12 ' A' ' 43' ' ' ILE . 1.6 mmtm -67.11 -39.55 86.69 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.296 -0.877 . . . . 0.0 110.017 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.768 HG13 HD23 ' A' ' 80' ' ' LEU . 56.1 t -57.83 -38.68 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.353 -0.842 . . . . 0.0 110.091 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.508 ' HD3' ' CZ ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -63.35 -50.68 69.01 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.281 -0.887 . . . . 0.0 110.157 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 49.1 tt0 -68.95 -17.05 63.89 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.432 -0.793 . . . . 0.0 109.959 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.737 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -79.78 -33.16 40.79 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.343 -0.848 . . . . 0.0 110.147 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.497 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 82.3 p -93.32 34.55 1.14 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.211 -0.93 . . . . 0.0 110.107 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.43 ' HB2' ' O ' ' A' ' 28' ' ' THR . 2.6 t -177.95 55.17 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.361 -0.837 . . . . 0.0 110.129 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -114.23 77.25 1.04 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.292 -0.88 . . . . 0.0 110.275 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.557 ' N ' ' CD ' ' A' ' 32' ' ' PRO . 0.1 OUTLIER -77.43 -48.23 2.4 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.279 -0.888 . . . . 0.0 110.186 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.557 ' CD ' ' N ' ' A' ' 31' ' ' ASP . 22.4 Cg_exo -60.08 176.5 0.73 Allowed 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 123.978 1.514 . . . . 0.0 110.382 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.411 ' HB2' ' O ' ' A' ' 32' ' ' PRO . 0.8 OUTLIER 63.58 171.78 0.16 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.193 -0.942 . . . . 0.0 110.563 179.864 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.76 179.16 1.5 Allowed Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.42 -73.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.773 0 O-C-N 124.016 1.535 . . . . 0.0 110.178 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.7 t -66.72 154.07 41.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.26 -0.9 . . . . 0.0 110.105 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.38 157.76 44.76 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.156 -0.965 . . . . 0.0 110.197 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.2 t -87.09 41.04 0.95 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.233 -0.917 . . . . 0.0 110.193 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.737 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.8 OUTLIER -114.79 -23.36 9.21 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.301 -0.874 . . . . 0.0 110.22 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 5.4 mtt -67.48 -62.2 1.53 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.171 -0.955 . . . . 0.0 110.234 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.44 -24.2 7.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.263 -0.898 . . . . 0.0 110.267 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.83 -54.02 8.06 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.156 -0.965 . . . . 0.0 110.176 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.589 HD11 ' HB2' ' A' ' 27' ' ' ALA . 79.3 mt -52.96 -32.85 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.149 -0.969 . . . . 0.0 109.951 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.527 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.23 -52.91 19.54 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.182 -0.949 . . . . 0.0 109.62 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.598 ' HA ' ' CD1' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -51.55 -21.46 2.52 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.021 -1.049 . . . . 0.0 109.455 179.268 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.953 HD22 ' HB2' ' A' ' 20' ' ' ALA . 4.6 mt -76.92 -40.97 45.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.429 -0.794 . . . . 0.0 110.133 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.689 HG21 ' CG2' ' A' ' 92' ' ' VAL . 42.9 p -53.97 -43.07 69.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.257 -0.902 . . . . 0.0 109.712 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.598 ' CD1' ' HA ' ' A' ' 45' ' ' ASP . 81.6 m-85 -40.48 -38.96 0.92 Allowed 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 119.945 -0.702 . . . . 0.0 109.529 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.466 ' O ' ' O ' ' A' ' 48' ' ' TYR . 13.7 m120 -58.08 -152.71 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.69 0.757 . . . . 0.0 110.168 179.057 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.7 t -128.11 -15.89 2.68 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.275 -177.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.646 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 0.3 OUTLIER -110.14 -48.1 6.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 CA-C-O 122.42 1.105 . . . . 0.0 108.569 179.151 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.695 ' HB1' ' HB3' ' A' ' 46' ' ' LEU . . . -48.82 -47.27 42.54 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.37 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.548 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 2.1 t80 -56.88 -54.7 43.48 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.374 -0.829 . . . . 0.0 109.819 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.88 -21.62 61.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.276 -0.89 . . . . 0.0 110.325 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' A' ' 51' ' ' VAL . 2.8 mm-40 -90.72 -19.6 23.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.309 -0.87 . . . . 0.0 110.048 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.629 HG21 HD13 ' A' ' 84' ' ' LEU . 7.3 mt -80.77 -70.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.383 -0.823 . . . . 0.0 110.0 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.574 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 95.8 mmm -45.17 -35.57 3.31 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -56.9 -59.56 4.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.345 -0.847 . . . . 0.0 109.806 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.451 ' HB3' HG11 ' A' ' 24' ' ' VAL . 0.0 OUTLIER -59.08 -25.64 63.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.333 -0.854 . . . . 0.0 109.966 179.653 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.692 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -74.15 -29.97 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.364 -0.835 . . . . 0.0 109.936 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.574 ' CD1' ' O ' ' A' ' 57' ' ' MET . 18.2 m95 -76.07 -44.76 37.43 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.158 -0.964 . . . . 0.0 110.387 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -49.06 79.11 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.222 -0.924 . . . . 0.0 110.434 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.508 ' CZ ' ' HD3' ' A' ' 25' ' ' ARG . 12.5 mmt85 -70.6 -32.02 69.23 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.22 -0.925 . . . . 0.0 110.32 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.995 HD22 HD11 ' A' ' 106' ' ' LEU . 3.9 mt -57.0 -18.67 14.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.319 -0.863 . . . . 0.0 110.503 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.446 ' O ' ' O ' ' A' ' 66' ' ' ASP . 19.0 t30 -104.53 37.93 2.01 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.238 -0.914 . . . . 0.0 109.935 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.472 ' OD2' ' HB3' ' A' ' 70' ' ' ASN . 1.0 OUTLIER -54.85 -165.99 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.362 -0.836 . . . . 0.0 110.181 -179.845 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.74 178.64 6.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.352 -0.842 . . . . 0.0 110.217 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -73.6 -54.09 6.93 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.626 -1.389 . . . . 0.0 109.626 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -64.04 -39.14 93.44 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.247 -1.149 . . . . 0.0 110.369 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.472 ' HB3' ' OD2' ' A' ' 66' ' ' ASP . 2.4 m120 -92.33 43.01 1.12 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.263 -0.898 . . . . 0.0 110.361 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 47.4 p-90 -65.97 -9.07 26.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.237 -0.914 . . . . 0.0 110.324 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 73' ' ' HIS . 1.3 ptp180 -55.56 -27.11 47.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.255 -0.903 . . . . 0.0 110.224 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.448 ' HB2' ' CG ' ' A' ' 66' ' ' ASP . 0.1 OUTLIER -72.71 -36.14 67.74 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 109.986 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.705 HG12 ' HE2' ' A' ' 78' ' ' MET . 55.6 t -62.62 -59.16 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.318 -0.864 . . . . 0.0 110.024 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.639 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 15.8 t80 -46.78 -43.57 18.36 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.253 -0.904 . . . . 0.0 110.055 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.497 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 7.5 mmtp -65.18 -37.11 86.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.256 -0.902 . . . . 0.0 110.166 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.742 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -65.9 -27.24 68.05 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.224 -0.922 . . . . 0.0 110.015 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.785 ' SD ' ' HB2' ' A' ' 127' ' ' ALA . 0.0 OUTLIER -71.4 -39.39 71.17 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.363 -0.836 . . . . 0.0 110.396 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 39.1 m -63.68 -35.81 81.77 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.168 -0.958 . . . . 0.0 110.129 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.768 HD23 HG13 ' A' ' 24' ' ' VAL . 33.3 tp -75.98 -37.38 58.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.145 -0.972 . . . . 0.0 109.614 179.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.558 ' HE2' HD11 ' A' ' 64' ' ' LEU . 3.4 ttp -72.7 -20.85 61.15 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.269 -0.894 . . . . 0.0 109.97 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.58 ' CA ' HD11 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -89.79 -36.29 15.22 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.266 -0.896 . . . . 0.0 110.244 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.633 ' CE1' ' CG2' ' A' ' 87' ' ' THR . 22.6 t80 -73.25 -42.25 62.76 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.363 -0.835 . . . . 0.0 110.698 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.65 ' CB ' HG11 ' A' ' 92' ' ' VAL . 57.4 mt -67.4 -30.12 69.79 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.255 -0.903 . . . . 0.0 110.365 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.015 HG21 HD11 ' A' ' 134' ' ' LEU . 17.7 mt -68.66 -13.11 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.084 -1.01 . . . . 0.0 110.039 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.67 -66.96 0.91 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 109.971 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.633 ' CG2' ' CE1' ' A' ' 83' ' ' TYR . 11.5 t -97.13 8.11 45.21 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.341 -0.849 . . . . 0.0 109.94 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.619 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -95.93 30.81 7.97 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.516 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.8 OUTLIER 72.29 156.98 0.17 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.305 -1.115 . . . . 0.0 110.288 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 6.8 mt-10 -68.43 -9.96 52.01 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.275 -0.89 . . . . 0.0 110.507 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -69.59 -45.53 68.39 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.305 -0.872 . . . . 0.0 109.638 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.689 ' CG2' HG21 ' A' ' 47' ' ' THR . 99.3 t -52.76 -40.53 35.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 121.503 -0.748 . . . . 0.0 109.768 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.8 m -68.48 -39.32 81.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.296 -0.878 . . . . 0.0 109.506 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 90' ' ' GLU . 8.7 mt-30 -55.85 -35.5 66.5 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.331 -0.856 . . . . 0.0 109.397 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.535 ' HA ' ' HG2' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -70.08 -40.2 75.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.451 -0.78 . . . . 0.0 109.014 178.956 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.492 ' SG ' HD22 ' A' ' 134' ' ' LEU . 21.7 t -55.3 -31.95 62.05 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.239 -0.913 . . . . 0.0 108.959 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.9 mttt -82.14 -25.87 34.0 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.567 -0.708 . . . . 0.0 109.924 179.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.535 ' HG2' ' HA ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -75.36 -21.98 57.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 109.856 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.504 ' N ' ' HG3' ' A' ' 98' ' ' GLU . 22.6 t-20 -140.77 44.79 1.82 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.407 -0.808 . . . . 0.0 109.977 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.473 ' SD ' ' HD3' ' A' ' 135' ' ' ARG . 28.5 ttp -59.92 -36.07 76.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.908 . . . . 0.0 110.025 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.448 ' O ' ' HB ' ' A' ' 105' ' ' THR . 8.7 m-30 -57.62 -27.04 62.42 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.389 -0.819 . . . . 0.0 109.972 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.984 ' O ' HG22 ' A' ' 105' ' ' THR . . . -69.06 -41.5 77.51 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.385 -0.822 . . . . 0.0 110.085 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.463 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 3.4 t -73.88 -29.7 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.373 -0.83 . . . . 0.0 109.84 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.627 ' HG2' HG21 ' A' ' 131' ' ' VAL . 7.5 mt-30 -83.45 -20.18 34.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.417 -0.802 . . . . 0.0 110.219 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.984 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.5 t -72.34 -20.0 61.55 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.255 -0.903 . . . . 0.0 110.19 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.995 HD11 HD22 ' A' ' 64' ' ' LEU . 12.2 mt -64.3 -39.75 94.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.267 -0.896 . . . . 0.0 109.937 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -52.56 -25.47 10.59 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.271 -0.893 . . . . 0.0 110.143 179.885 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.442 ' N ' ' HG3' ' A' ' 107' ' ' LYS . 0.8 OUTLIER -84.27 -35.88 23.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 179.795 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.409 ' C ' ' O ' ' A' ' 108' ' ' ASP . 0.5 OUTLIER -43.08 102.41 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.354 -0.841 . . . . 0.0 110.217 179.911 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 108' ' ' ASP . 12.6 pt20 -145.76 154.98 42.64 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.23 -0.919 . . . . 0.0 110.206 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -162.91 101.69 1.0 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.294 -0.879 . . . . 0.0 110.168 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.64 HG21 ' OD1' ' A' ' 118' ' ' ASP . 2.0 p -144.17 19.19 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.341 -0.85 . . . . 0.0 110.283 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -54.74 -55.94 24.52 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.237 -0.914 . . . . 0.0 110.198 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.521 ' HG3' ' N ' ' A' ' 115' ' ' ASP . 0.1 OUTLIER -96.96 -45.74 6.48 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.252 -0.905 . . . . 0.0 110.325 -179.951 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.521 ' N ' ' HG3' ' A' ' 114' ' ' ARG . 0.1 OUTLIER -49.06 -61.25 2.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.382 -0.824 . . . . 0.0 110.202 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.529 ' CA ' HG22 ' A' ' 112' ' ' VAL . . . 94.55 -16.89 60.17 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.8 mttm -88.32 109.93 20.36 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.254 -1.145 . . . . 0.0 110.25 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.64 ' OD1' HG21 ' A' ' 112' ' ' VAL . 1.2 m-20 -84.82 64.27 8.5 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.258 -0.901 . . . . 0.0 110.201 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.28 21.96 10.27 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.176 -0.953 . . . . 0.0 110.156 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -95.84 18.84 56.67 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.456 -1.458 . . . . 0.0 109.456 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.564 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.6 p -83.8 -43.55 17.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.263 -1.14 . . . . 0.0 110.223 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.564 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.7 OUTLIER -39.37 -44.01 1.27 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.59 -0.694 . . . . 0.0 110.61 -179.843 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.65 HG13 ' HE1' ' A' ' 78' ' ' MET . 1.4 t -78.86 -48.67 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.339 -0.85 . . . . 0.0 110.202 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.445 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -44.04 -51.05 8.14 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.272 -0.893 . . . . 0.0 111.201 -179.365 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.486 ' OE2' ' HA ' ' A' ' 122' ' ' ASN . 14.2 pt-20 -72.72 -34.26 66.99 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.273 -0.892 . . . . 0.0 111.186 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.744 ' HB3' ' HE3' ' A' ' 78' ' ' MET . 0.8 OUTLIER -59.04 -54.6 45.29 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.972 -1.08 . . . . 0.0 110.289 -179.776 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.785 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -59.83 -42.94 94.66 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.338 -0.851 . . . . 0.0 110.488 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -60.5 -34.62 74.34 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.236 -0.915 . . . . 0.0 110.477 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.537 ' O ' ' HB3' ' A' ' 132' ' ' ALA . 1.9 mt-30 -65.48 -42.87 91.72 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.298 -0.876 . . . . 0.0 110.48 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.846 HD21 HD12 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -58.14 -56.09 26.53 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.034 -1.042 . . . . 0.0 109.948 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.627 HG21 ' HG2' ' A' ' 104' ' ' GLN . 55.4 t -53.78 -23.6 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.449 -0.782 . . . . 0.0 109.837 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 129' ' ' GLN . . . -76.22 -56.12 4.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.447 -0.783 . . . . 0.0 110.503 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.98 -34.16 54.67 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.342 -0.849 . . . . 0.0 110.582 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 1.015 HD11 HG21 ' A' ' 85' ' ' ILE . 0.2 OUTLIER -79.63 -58.95 2.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.188 -0.945 . . . . 0.0 110.451 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.473 ' HD3' ' SD ' ' A' ' 100' ' ' MET . 3.7 ttp180 -92.09 48.23 1.4 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.282 -0.886 . . . . 0.0 110.367 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 132' ' ' ALA . 11.7 t70 -84.83 -43.05 14.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.197 -0.939 . . . . 0.0 110.224 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -119.16 -179.73 3.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.183 -0.948 . . . . 0.0 110.19 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -90.39 178.91 6.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.25 -0.906 . . . . 0.0 110.148 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -53.59 114.6 1.59 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.269 -0.894 . . . . 0.0 110.088 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.473 HD23 ' HG3' ' A' ' 143' ' ' GLU . 4.6 tp -164.05 128.54 2.75 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 110.294 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 142' ' ' GLU . 0.0 OUTLIER -91.62 167.33 12.29 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.298 -0.876 . . . . 0.0 110.074 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.459 ' CB ' ' O ' ' A' ' 141' ' ' ARG . 0.0 OUTLIER 65.55 61.55 0.69 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.178 -0.951 . . . . 0.0 110.193 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.473 ' HG3' HD23 ' A' ' 140' ' ' LEU . 8.4 mm-40 -140.87 60.3 1.52 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.201 -0.937 . . . . 0.0 110.23 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.41 ' OXT' ' CG ' ' A' ' 144' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.183 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.02 75.39 1.51 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.192 -1.181 . . . . 0.0 110.316 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' -1' ' ' SER . . . . . 0.508 ' O ' ' CG ' ' A' ' 0' ' ' ARG . 0.9 OUTLIER -125.37 146.56 49.53 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.298 -0.876 . . . . 0.0 110.117 179.939 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 0' ' ' ARG . . . . . 0.508 ' CG ' ' O ' ' A' ' -1' ' ' SER . 0.0 OUTLIER 174.23 83.02 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.282 -0.886 . . . . 0.0 110.155 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -82.53 -8.36 59.61 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.257 -0.902 . . . . 0.0 110.297 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m -130.78 137.83 49.64 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.145 -0.972 . . . . 0.0 110.331 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.43 ' O ' ' CB ' ' A' ' 4' ' ' SER . 28.6 m -90.78 -17.88 25.87 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.232 -0.918 . . . . 0.0 110.257 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' A' ' 3' ' ' THR . 2.1 t 64.76 -175.29 0.17 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.204 -0.935 . . . . 0.0 110.173 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 6' ' ' LEU . 55.2 m -115.89 -70.37 0.8 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.921 . . . . 0.0 110.244 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.406 ' HA ' HD13 ' A' ' 6' ' ' LEU . 0.2 OUTLIER 61.92 129.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.331 -0.855 . . . . 0.0 110.301 -179.995 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -86.04 44.6 1.14 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.26 -0.9 . . . . 0.0 110.23 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 56.9 ttt180 -45.66 -38.8 7.13 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 110.225 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -70.32 113.34 7.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.172 -0.955 . . . . 0.0 110.216 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 66.4 mtt -88.59 -168.96 2.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.245 -0.909 . . . . 0.0 110.239 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -78.28 -154.03 0.07 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.293 -0.879 . . . . 0.0 110.134 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.46 ' O ' ' O ' ' A' ' 13' ' ' ILE . 17.5 t-20 -168.75 50.86 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.193 -0.942 . . . . 0.0 110.244 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.46 ' O ' ' O ' ' A' ' 12' ' ' ASN . 20.4 mt 60.24 142.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.188 -0.945 . . . . 0.0 110.199 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.418 ' CG1' ' CE1' ' A' ' 17' ' ' TYR . 4.6 t -88.81 110.81 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.236 -0.915 . . . . 0.0 110.124 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.03 -146.81 0.32 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.203 -0.936 . . . . 0.0 110.295 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -83.57 84.07 7.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.235 -0.916 . . . . 0.0 110.49 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.478 ' CG ' ' O ' ' A' ' 17' ' ' TYR . 19.0 p90 -114.58 130.2 56.75 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.239 -0.913 . . . . 0.0 110.197 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.507 ' O ' ' CB ' ' A' ' 19' ' ' GLU . 15.0 t -145.77 -65.97 0.31 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.31 -0.869 . . . . 0.0 110.075 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.507 ' CB ' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER 166.38 -67.42 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.429 -0.795 . . . . 0.0 110.675 179.975 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.899 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -71.16 -55.23 8.58 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.193 -0.942 . . . . 0.0 110.625 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HG3' HG12 ' A' ' 22' ' ' ILE . 19.7 pt-20 -41.01 -27.45 0.06 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.291 -0.881 . . . . 0.0 110.461 -179.69 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.465 HG12 ' HG3' ' A' ' 21' ' ' GLU . 23.5 mm -82.74 -57.81 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.271 -0.893 . . . . 0.0 110.308 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.866 ' O ' HD11 ' A' ' 43' ' ' ILE . 26.2 mttt -53.9 -19.05 3.96 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.241 -0.912 . . . . 0.0 110.409 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.934 HG21 ' HA ' ' A' ' 56' ' ' ILE . 6.7 t -89.32 -37.39 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.204 -0.935 . . . . 0.0 110.12 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.501 ' NH2' ' NH1' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -64.66 -36.95 85.93 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.295 -0.878 . . . . 0.0 110.228 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -85.19 -40.56 16.55 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.273 -0.892 . . . . 0.0 110.259 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.613 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . . . -49.48 -38.51 30.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 0.0 110.174 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.578 HG22 ' HA ' ' A' ' 77' ' ' ALA . 63.6 p -94.16 50.03 1.36 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.307 -0.87 . . . . 0.0 110.25 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.448 ' HB2' ' O ' ' A' ' 28' ' ' THR . 46.6 t -178.17 -178.67 0.67 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.254 -0.904 . . . . 0.0 110.194 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.421 ' O ' ' OD1' ' A' ' 31' ' ' ASP . 17.5 m-80 -74.85 178.85 5.23 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.201 -0.937 . . . . 0.0 110.185 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 0.6 OUTLIER -143.61 169.22 10.85 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.267 -0.896 . . . . 0.0 110.253 -179.974 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.4 ' O ' ' C ' ' A' ' 33' ' ' TRP . 21.2 Cg_exo -61.16 -166.79 0.04 OUTLIER 'Trans proline' 0 C--N 1.307 -1.623 0 O-C-N 123.924 1.486 . . . . 0.0 110.376 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.4 ' C ' ' O ' ' A' ' 32' ' ' PRO . 0.7 OUTLIER -43.87 -38.16 3.2 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.188 -0.945 . . . . 0.0 110.398 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 136.83 77.42 0.08 OUTLIER Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -64.07 -57.4 0.34 Allowed 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 124.021 1.537 . . . . 0.0 110.268 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 p -151.44 -167.71 2.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.21 -0.931 . . . . 0.0 110.132 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.507 ' O ' ' N ' ' A' ' 39' ' ' LEU . 13.4 m -120.41 -34.73 3.57 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.198 -0.939 . . . . 0.0 110.303 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.8 p -48.59 90.77 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.254 -0.904 . . . . 0.0 110.244 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.613 ' CD1' ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -143.15 -38.0 0.35 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.28 -0.887 . . . . 0.0 110.319 -179.92 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.574 ' HG3' ' CG ' ' A' ' 83' ' ' TYR . 36.2 tpp -82.17 -60.14 2.32 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.514 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 7.8 t -56.89 -21.51 30.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.303 -0.873 . . . . 0.0 110.267 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -76.51 -55.78 5.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -0.906 . . . . 0.0 110.221 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.95 HG21 HD11 ' A' ' 80' ' ' LEU . 36.2 mt -49.03 -36.64 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.18 -0.95 . . . . 0.0 110.157 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.521 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -67.63 -55.0 15.04 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.204 -0.935 . . . . 0.0 109.489 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.42 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 22.8 m-20 -50.08 -23.45 2.11 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.097 -1.002 . . . . 0.0 109.14 179.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.923 ' HB3' HD11 ' A' ' 56' ' ' ILE . 7.4 mt -79.1 -40.35 31.36 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.581 -0.699 . . . . 0.0 109.91 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.707 HG21 ' HB3' ' A' ' 84' ' ' LEU . 80.7 p -47.54 -39.71 17.07 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.177 -0.952 . . . . 0.0 109.174 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.575 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 57.9 m-85 -46.06 -50.3 15.36 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 119.384 -0.926 . . . . 0.0 109.289 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.529 ' O ' ' C ' ' A' ' 50' ' ' VAL . 16.5 m-20 -68.14 91.21 0.35 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.57 0.7 . . . . 0.0 110.765 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.529 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -11.0 -57.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.712 178.138 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.527 ' N ' ' O ' ' A' ' 49' ' ' ASN . 2.9 t -64.92 -66.25 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 120.928 -1.108 . . . . 0.0 110.301 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.612 ' O ' HD12 ' A' ' 56' ' ' ILE . . . -37.57 -40.45 0.39 Allowed 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 121.146 0.498 . . . . 0.0 110.762 -177.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.599 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 15.1 t80 -59.07 -54.01 51.9 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.334 -0.854 . . . . 0.0 109.998 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.5 t -55.97 -33.22 64.58 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.19 -0.944 . . . . 0.0 109.862 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -75.42 -27.1 58.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.327 -0.858 . . . . 0.0 109.898 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.934 ' HA ' HG21 ' A' ' 24' ' ' VAL . 8.7 mt -79.68 -70.13 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.394 -0.816 . . . . 0.0 110.026 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.599 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 75.3 mmm -46.59 -36.35 6.8 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.274 -0.891 . . . . 0.0 109.563 179.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.4 m -55.16 -62.49 1.63 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.366 -0.834 . . . . 0.0 109.939 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.428 ' H ' ' HE3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -59.35 -21.4 59.76 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.188 -0.945 . . . . 0.0 109.798 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.549 ' CG1' HD23 ' A' ' 80' ' ' LEU . 1.0 OUTLIER -76.08 -30.29 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.41 -0.806 . . . . 0.0 109.748 179.871 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.44 ' CD1' ' O ' ' A' ' 57' ' ' MET . 14.0 m95 -76.13 -46.73 27.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.307 -0.87 . . . . 0.0 110.346 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.3 mptt -55.84 -47.67 76.83 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.25 -0.906 . . . . 0.0 110.392 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.501 ' NH1' ' NH2' ' A' ' 25' ' ' ARG . 6.0 mmp_? -75.88 -10.9 59.81 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.326 -0.859 . . . . 0.0 110.338 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.817 ' O ' HD21 ' A' ' 106' ' ' LEU . 6.6 mt -83.55 -17.68 40.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.194 -0.941 . . . . 0.0 110.351 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.472 ' O ' ' O ' ' A' ' 66' ' ' ASP . 14.5 m-20 -111.11 42.29 1.67 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.329 -0.857 . . . . 0.0 110.073 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.473 ' OD2' ' HB2' ' A' ' 73' ' ' HIS . 0.9 OUTLIER -53.85 -167.04 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.32 -0.862 . . . . 0.0 110.291 -179.921 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.413 ' O ' ' C ' ' A' ' 68' ' ' GLY . 12.9 p80 -162.72 -169.67 2.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.23 -0.919 . . . . 0.0 110.255 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.535 ' HA2' ' CE2' ' A' ' 111' ' ' TYR . . . 43.82 -121.04 3.43 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.2 ttpt -120.68 66.33 0.85 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.355 -1.086 . . . . 0.0 110.091 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -138.36 25.42 2.67 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.32 -0.862 . . . . 0.0 110.361 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.541 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 28.7 p-90 -55.03 -18.99 5.99 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 0.0 110.332 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.541 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 15.2 mtm-85 -48.85 -40.8 30.91 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.208 -0.933 . . . . 0.0 110.235 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.473 ' HB2' ' OD2' ' A' ' 66' ' ' ASP . 17.0 m170 -68.04 -47.81 67.37 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.234 -0.917 . . . . 0.0 110.094 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.631 HG11 ' CG1' ' A' ' 123' ' ' VAL . 7.0 t -46.37 -52.42 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.349 -0.844 . . . . 0.0 110.172 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.48 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 19.8 t80 -54.87 -49.05 72.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.342 -0.849 . . . . 0.0 110.33 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.539 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 10.9 mttm -61.92 -22.81 65.9 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.24 -0.913 . . . . 0.0 110.091 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.754 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -80.05 -23.92 41.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.239 -0.913 . . . . 0.0 109.936 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.556 ' HE2' HG12 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -73.81 -38.45 64.57 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.332 -0.855 . . . . 0.0 110.004 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 76' ' ' LYS . 8.9 t -72.1 -34.32 68.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.207 -0.933 . . . . 0.0 110.046 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.95 HD11 HG21 ' A' ' 43' ' ' ILE . 10.1 tp -68.41 -62.0 1.59 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.232 -0.917 . . . . 0.0 108.994 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.819 ' HE1' HG22 ' A' ' 103' ' ' VAL . 2.9 ttm -53.69 -32.32 51.29 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.406 -0.808 . . . . 0.0 109.9 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.7 ' HA ' HD12 ' A' ' 85' ' ' ILE . 2.8 tt0 -72.74 -32.82 65.96 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.247 -0.908 . . . . 0.0 109.634 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.574 ' CG ' ' HG3' ' A' ' 40' ' ' MET . 20.9 t80 -70.75 -38.88 73.53 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.543 -0.723 . . . . 0.0 110.487 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.788 ' HB2' HG11 ' A' ' 92' ' ' VAL . 1.7 mt -70.55 -32.98 70.62 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.107 -0.995 . . . . 0.0 109.578 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.927 HD13 HD21 ' A' ' 134' ' ' LEU . 71.5 mt -61.76 -26.34 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.181 -0.949 . . . . 0.0 110.082 179.654 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.02 -70.64 0.62 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.385 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.521 HG23 ' HB1' ' A' ' 44' ' ' ALA . 13.0 t -94.1 -23.05 18.12 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.236 -0.915 . . . . 0.0 110.4 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.575 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -44.36 -84.54 0.01 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' A' ' 88' ' ' GLY . 14.4 p -178.09 156.37 1.02 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.234 -1.156 . . . . 0.0 110.31 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.78 -21.56 11.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.282 -0.886 . . . . 0.0 110.2 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -70.74 -44.84 65.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.928 . . . . 0.0 109.86 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.788 HG11 ' HB2' ' A' ' 84' ' ' LEU . 55.2 t -53.27 -38.45 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.361 -0.837 . . . . 0.0 109.958 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 96' ' ' CYS . 70.5 m -70.79 -41.06 72.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.316 -0.865 . . . . 0.0 109.98 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.417 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 31.3 mm-40 -57.07 -54.88 41.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.304 -0.872 . . . . 0.0 109.992 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.9 tp60 -55.86 -36.8 67.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.424 -0.797 . . . . 0.0 109.877 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 93' ' ' SER . 4.8 m -60.15 -36.37 77.38 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.315 -0.865 . . . . 0.0 109.736 179.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -74.92 -31.8 61.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.683 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 82.2 mt-10 -81.23 -14.78 57.13 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.473 -0.767 . . . . 0.0 110.027 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -123.18 32.87 5.54 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.281 -0.887 . . . . 0.0 110.174 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.6 ttm -58.2 -24.7 60.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.325 -0.86 . . . . 0.0 110.133 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.462 ' O ' ' HB ' ' A' ' 105' ' ' THR . 14.5 m-85 -69.07 -31.83 70.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.919 . . . . 0.0 110.104 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.933 ' O ' HG22 ' A' ' 105' ' ' THR . . . -75.08 -40.03 60.36 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.48 -0.763 . . . . 0.0 110.26 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.819 HG22 ' HE1' ' A' ' 81' ' ' MET . 3.6 t -71.63 -32.37 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.418 -0.801 . . . . 0.0 110.14 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -86.0 -23.36 26.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.281 -0.887 . . . . 0.0 110.508 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.933 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.3 t -51.37 -25.69 6.49 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.082 -1.011 . . . . 0.0 110.002 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.817 HD21 ' O ' ' A' ' 64' ' ' LEU . 50.5 mt -62.39 -43.55 98.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.309 -0.869 . . . . 0.0 110.077 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.51 ' HA ' ' HG2' ' A' ' 124' ' ' ARG . 49.0 mttt -43.73 -36.52 2.28 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.191 -0.943 . . . . 0.0 109.965 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.429 ' O ' ' N ' ' A' ' 110' ' ' GLN . 25.0 t0 -87.03 -31.81 20.34 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.401 -0.812 . . . . 0.0 110.196 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -47.59 97.65 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -0.87 . . . . 0.0 110.02 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.429 ' N ' ' O ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -138.66 151.7 47.42 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.318 -0.864 . . . . 0.0 110.188 -179.913 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.535 ' CE2' ' HA2' ' A' ' 68' ' ' GLY . 0.1 OUTLIER -153.91 105.39 2.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.357 -0.839 . . . . 0.0 110.049 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.739 ' O ' HG12 ' A' ' 112' ' ' VAL . 78.4 t -139.81 57.99 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.27 -0.894 . . . . 0.0 110.238 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -92.62 -42.37 9.69 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.172 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.585 ' CG ' ' N ' ' A' ' 115' ' ' ASP . 0.8 OUTLIER -99.9 -47.17 5.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.203 -0.935 . . . . 0.0 109.916 179.928 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.585 ' N ' ' CG ' ' A' ' 114' ' ' ARG . 6.5 m-20 -60.71 -28.31 68.55 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.525 -0.735 . . . . 0.0 110.124 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 54.01 28.07 39.65 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.532 ' N ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -160.93 102.8 1.3 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -1.16 . . . . 0.0 110.206 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.626 ' CG ' HG21 ' A' ' 112' ' ' VAL . 4.2 m-20 -51.75 115.82 1.83 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.211 -0.93 . . . . 0.0 110.247 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -121.82 -12.94 8.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.27 -0.894 . . . . 0.0 110.251 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -93.83 46.66 2.28 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p -78.98 -41.35 23.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.272 -1.134 . . . . 0.0 110.056 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.0 OUTLIER -36.12 -30.33 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.143 0.497 . . . . 0.0 110.582 -179.837 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.631 ' CG1' HG11 ' A' ' 74' ' ' VAL . 4.6 t -78.16 -58.45 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 0.0 109.826 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.51 ' HG2' ' HA ' ' A' ' 107' ' ' LYS . 10.4 mtp-105 -42.1 -47.29 4.52 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.243 -0.91 . . . . 0.0 111.038 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -72.28 -48.56 41.49 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.381 -0.825 . . . . 0.0 111.662 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.541 ' HA ' ' CE ' ' A' ' 126' ' ' LYS . 0.0 OUTLIER -52.04 -53.6 40.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.837 -1.164 . . . . 0.0 110.15 -179.278 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.462 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -52.2 -43.25 64.1 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.341 -0.849 . . . . 0.0 110.146 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.3 tmmm? -55.21 -36.59 66.12 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.207 -0.933 . . . . 0.0 110.371 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -57.45 3.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.161 -0.962 . . . . 0.0 110.294 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 1.039 ' O ' HD23 ' A' ' 134' ' ' LEU . 12.2 tp -46.88 -25.5 0.78 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.208 -0.933 . . . . 0.0 110.041 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 30.0 t -86.64 -36.47 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.219 -0.925 . . . . 0.0 110.155 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.73 -60.46 3.07 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.218 -0.927 . . . . 0.0 110.22 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.98 -28.41 9.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.056 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 1.039 HD23 ' O ' ' A' ' 130' ' ' LEU . 0.8 OUTLIER -67.12 -57.82 6.07 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.28 -0.888 . . . . 0.0 110.261 179.924 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -86.35 96.03 9.85 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.288 -0.882 . . . . 0.0 110.336 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -117.34 -68.15 0.94 Allowed 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.243 -0.91 . . . . 0.0 110.214 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 49.21 92.15 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.262 -0.899 . . . . 0.0 110.252 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -169.06 139.85 2.35 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.249 -0.907 . . . . 0.0 110.203 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.28 131.77 42.33 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.233 -0.917 . . . . 0.0 110.174 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.63 -56.09 1.5 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 110.235 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.77 83.66 2.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.289 -0.882 . . . . 0.0 110.32 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.409 ' C ' ' OE1' ' A' ' 143' ' ' GLU . 0.5 OUTLIER -109.11 141.29 41.51 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.311 -0.868 . . . . 0.0 110.25 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.418 ' CD ' ' N ' ' A' ' 143' ' ' GLU . 5.5 pm0 -140.87 38.78 1.81 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.22 -0.925 . . . . 0.0 110.149 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.142 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -2' ' ' SER . . . . . 0.429 ' O ' ' CB ' ' A' ' -1' ' ' SER . 1.2 m 57.44 50.15 11.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -1.132 . . . . 0.0 110.221 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' -1' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' -2' ' ' SER . 0.3 OUTLIER 64.98 78.54 0.28 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.281 -0.887 . . . . 0.0 110.234 179.952 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.54 121.89 22.78 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 110.21 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -156.15 -52.63 0.08 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 110.276 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.1 m -125.05 116.95 22.92 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.28 -0.888 . . . . 0.0 110.228 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 27.0 m -122.48 -7.95 8.61 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.344 -0.847 . . . . 0.0 110.215 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.2 p -86.26 -150.44 0.15 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.296 -0.877 . . . . 0.0 110.236 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 6' ' ' LEU . 53.4 p -157.22 148.88 22.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.298 -0.876 . . . . 0.0 110.16 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.448 ' O ' ' HD3' ' A' ' 8' ' ' ARG . 34.3 tp -179.21 -39.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.166 -0.959 . . . . 0.0 110.331 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.19 102.22 0.08 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.221 -0.924 . . . . 0.0 110.21 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.448 ' HD3' ' O ' ' A' ' 6' ' ' LEU . 5.8 mpt_? -68.42 168.09 13.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.202 -0.936 . . . . 0.0 110.197 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -51.12 119.73 4.28 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.251 -0.905 . . . . 0.0 110.351 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 23.2 mmt -100.75 -49.26 4.22 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.305 -0.872 . . . . 0.0 110.274 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -53.47 174.26 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.16 -0.962 . . . . 0.0 110.315 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.462 ' O ' ' HB ' ' A' ' 13' ' ' ILE . 52.9 p-10 -129.84 72.01 1.47 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.208 -0.932 . . . . 0.0 110.283 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.462 ' HB ' ' O ' ' A' ' 12' ' ' ASN . 26.1 mt 60.2 140.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.273 -0.892 . . . . 0.0 110.349 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 4.0 t -100.15 121.41 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.214 -0.929 . . . . 0.0 110.103 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.6 m170 -81.86 -16.58 50.27 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.258 -0.901 . . . . 0.0 110.18 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 44.78 45.48 8.31 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.322 -0.861 . . . . 0.0 110.226 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.537 ' CG ' ' O ' ' A' ' 17' ' ' TYR . 26.8 p90 -93.66 124.49 37.69 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.14 -0.975 . . . . 0.0 110.163 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 17' ' ' TYR . 17.9 t -177.08 45.66 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.28 -0.888 . . . . 0.0 110.171 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -136.65 -65.11 0.57 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.202 -0.936 . . . . 0.0 110.268 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.893 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -58.53 -46.42 86.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.378 -0.826 . . . . 0.0 110.286 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.474 ' OE2' ' CG1' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -43.71 -28.28 0.4 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.14 -0.975 . . . . 0.0 110.081 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.474 ' CG1' ' OE2' ' A' ' 21' ' ' GLU . 9.9 mt -86.76 -54.08 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.291 -0.881 . . . . 0.0 110.133 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.544 ' O ' HD11 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -44.6 -37.87 3.88 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 110.153 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.771 HG21 ' HA ' ' A' ' 56' ' ' ILE . 51.2 t -75.06 -48.57 31.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.232 -0.917 . . . . 0.0 110.145 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -46.66 -41.19 14.42 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.136 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.407 ' O ' ' C ' ' A' ' 27' ' ' ALA . 0.0 OUTLIER -74.05 -47.46 36.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.333 -0.855 . . . . 0.0 110.107 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.697 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -44.44 -47.17 9.88 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.235 -0.916 . . . . 0.0 110.078 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.511 ' HA ' ' HB2' ' A' ' 76' ' ' LYS . 39.5 p -74.3 -31.19 62.39 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.32 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 51.5 m -68.68 162.29 26.39 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.256 -0.902 . . . . 0.0 110.137 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -48.43 169.08 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.203 -0.936 . . . . 0.0 110.139 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -114.85 104.73 53.97 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.21 -0.931 . . . . 0.0 110.228 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -55.67 -163.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 124.069 1.562 . . . . 0.0 110.341 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.1 m95 -96.28 174.78 6.71 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.21 -0.931 . . . . 0.0 110.454 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 120.73 99.72 1.71 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -57.6 -61.5 0.29 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 124.027 1.54 . . . . 0.0 110.298 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.6 m -66.97 94.68 0.34 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.916 . . . . 0.0 110.065 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 96.1 p -144.33 166.74 24.23 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.199 -0.938 . . . . 0.0 110.238 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -172.29 97.0 0.15 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.295 -0.878 . . . . 0.0 110.13 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.697 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.8 OUTLIER -118.82 -22.31 7.43 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.167 -0.958 . . . . 0.0 110.25 -179.942 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -50.67 22.71 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 110.218 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.434 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 89.0 p -58.47 -29.19 65.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -73.11 -47.65 42.47 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.266 -0.896 . . . . 0.0 110.241 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.906 HG21 HD11 ' A' ' 80' ' ' LEU . 23.1 mt -57.68 -38.65 65.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.233 -0.917 . . . . 0.0 110.226 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.649 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -68.61 -47.18 67.34 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.058 -1.027 . . . . 0.0 109.43 179.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.509 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 3.6 t70 -55.41 -18.48 6.94 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.117 -0.99 . . . . 0.0 109.12 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.893 HD13 ' CB ' ' A' ' 20' ' ' ALA . 24.7 mt -85.22 -33.52 22.22 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.531 -0.73 . . . . 0.0 110.191 179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.592 HG21 ' HB3' ' A' ' 84' ' ' LEU . 38.9 p -56.08 -43.74 78.31 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.0 -1.062 . . . . 0.0 109.233 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.544 ' CE2' ' O ' ' A' ' 87' ' ' THR . 95.0 m-85 -41.26 -37.51 0.97 Allowed 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.59 179.537 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.542 ' O ' ' C ' ' A' ' 50' ' ' VAL . 0.8 OUTLIER -80.66 91.21 5.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.591 -0.693 . . . . 0.0 110.365 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.542 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.09 -58.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.26 178.095 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.541 ' N ' ' O ' ' A' ' 49' ' ' ASN . 2.9 t -65.11 -66.03 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.032 -1.042 . . . . 0.0 110.143 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.742 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -38.19 -44.5 0.86 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.295 0.569 . . . . 0.0 110.522 -177.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.543 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 0.6 OUTLIER -56.73 -55.85 28.88 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.425 -0.797 . . . . 0.0 109.925 179.715 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -54.67 -31.81 58.29 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.194 -0.941 . . . . 0.0 110.232 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -77.79 -26.94 50.04 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.307 -0.871 . . . . 0.0 110.193 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.771 ' HA ' HG21 ' A' ' 24' ' ' VAL . 6.3 mt -78.36 -70.3 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.326 -0.859 . . . . 0.0 110.216 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.466 ' HB3' ' HE2' ' A' ' 57' ' ' MET . 3.5 mtp -46.64 -35.48 6.0 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.177 -0.952 . . . . 0.0 109.762 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 t -55.85 -60.97 2.7 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.258 -0.901 . . . . 0.0 109.659 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.458 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.6 OUTLIER -60.45 -20.14 58.86 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.266 -0.897 . . . . 0.0 109.679 179.47 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.627 HD11 ' HG ' ' A' ' 80' ' ' LEU . 1.2 mt -75.67 -31.18 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.413 -0.804 . . . . 0.0 109.645 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -74.74 -50.27 18.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -0.906 . . . . 0.0 110.202 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -56.14 18.4 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.249 -0.907 . . . . 0.0 110.327 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -68.61 -14.18 62.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.246 -0.909 . . . . 0.0 110.427 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.8 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 4.1 mt -77.69 -25.25 49.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.22 -0.925 . . . . 0.0 110.569 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.462 ' O ' ' O ' ' A' ' 66' ' ' ASP . 1.4 m120 -113.83 43.15 1.87 Allowed 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.343 -0.848 . . . . 0.0 110.185 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.462 ' O ' ' O ' ' A' ' 65' ' ' ASN . 2.3 p-10 -56.03 -159.96 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.353 -0.842 . . . . 0.0 110.427 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.573 ' CD2' ' HB2' ' A' ' 69' ' ' LYS . 0.8 OUTLIER -108.53 -167.37 1.22 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.135 -0.978 . . . . 0.0 110.387 179.974 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -85.91 60.55 4.62 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.573 ' HB2' ' CD2' ' A' ' 67' ' ' HIS . 0.4 OUTLIER -149.93 -74.62 0.16 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.322 -1.105 . . . . 0.0 110.197 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -99.02 50.06 0.96 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.341 -0.849 . . . . 0.0 110.492 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.493 ' CZ2' ' HG3' ' A' ' 119' ' ' GLN . 0.6 OUTLIER -58.01 -14.09 5.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.116 -0.99 . . . . 0.0 110.25 179.816 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -47.5 -35.82 9.37 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.161 -0.962 . . . . 0.0 109.592 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -61.73 -47.86 83.33 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.343 -0.848 . . . . 0.0 109.742 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.636 HG12 ' HE1' ' A' ' 78' ' ' MET . 58.9 t -50.67 -46.19 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.331 -0.855 . . . . 0.0 109.715 179.553 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.808 ' HB2' HG23 ' A' ' 123' ' ' VAL . 8.4 t80 -57.18 -52.18 66.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.321 -0.862 . . . . 0.0 109.804 179.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.511 ' HB2' ' HA ' ' A' ' 28' ' ' THR . 25.9 mmmt -62.54 -19.37 63.59 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.298 -0.877 . . . . 0.0 109.768 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.8 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -79.48 -30.97 42.28 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.399 -0.813 . . . . 0.0 109.927 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' MET . . . . . 1.028 ' HE1' HG22 ' A' ' 123' ' ' VAL . 1.2 mpp? -68.36 -46.47 70.01 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 109.859 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.8 t -67.57 -31.86 72.22 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.249 -0.907 . . . . 0.0 109.808 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.906 HD11 HG21 ' A' ' 43' ' ' ILE . 11.2 tp -66.3 -65.4 0.68 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.347 -0.846 . . . . 0.0 109.033 178.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.928 ' HG2' HD21 ' A' ' 130' ' ' LEU . 9.3 ttt -49.38 -32.75 12.1 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.406 -0.809 . . . . 0.0 110.122 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.717 ' HA ' HD12 ' A' ' 85' ' ' ILE . 1.3 tm-20 -70.36 -38.07 74.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.102 -0.999 . . . . 0.0 110.025 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.834 ' CE1' HG21 ' A' ' 87' ' ' THR . 19.7 t80 -68.21 -34.31 76.01 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.255 -0.903 . . . . 0.0 110.677 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.874 ' HB2' HG11 ' A' ' 92' ' ' VAL . 2.8 mt -80.76 -21.79 40.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.019 -1.051 . . . . 0.0 109.924 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.015 HD13 HD11 ' A' ' 134' ' ' LEU . 19.9 mt -65.93 -24.64 34.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.154 -0.966 . . . . 0.0 109.534 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -103.31 -61.38 1.42 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.361 -0.837 . . . . 0.0 109.901 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.834 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.0 t -98.34 11.39 38.18 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.299 -0.876 . . . . 0.0 109.974 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.652 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -102.2 29.69 11.96 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 72.6 153.32 0.13 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.391 -1.064 . . . . 0.0 110.43 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.78 -8.71 22.88 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.367 -0.833 . . . . 0.0 110.378 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.416 ' O ' ' HB2' ' A' ' 94' ' ' GLN . 10.4 mmp_? -70.96 -45.07 64.75 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.284 -0.885 . . . . 0.0 109.842 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.874 HG11 ' HB2' ' A' ' 84' ' ' LEU . 91.0 t -52.45 -47.09 47.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 O-C-N 121.409 -0.807 . . . . 0.0 109.898 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.8 t -64.55 -36.78 85.34 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.215 -0.928 . . . . 0.0 109.92 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.477 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 56.3 mm-40 -58.08 -46.65 85.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.248 -0.908 . . . . 0.0 109.844 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.457 ' HB3' ' SD ' ' A' ' 57' ' ' MET . 4.8 tp60 -60.25 -39.82 88.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.835 . . . . 0.0 109.59 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.823 ' SG ' HD22 ' A' ' 134' ' ' LEU . 51.5 t -55.02 -40.82 70.59 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.364 -0.835 . . . . 0.0 109.564 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -29.58 64.75 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.48 -0.763 . . . . 0.0 109.669 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 0.5 OUTLIER -81.83 -12.52 58.46 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.479 -0.763 . . . . 0.0 110.006 179.788 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.419 ' OD1' ' O ' ' A' ' 98' ' ' GLU . 70.4 m-20 -137.15 42.18 2.42 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.309 -0.869 . . . . 0.0 110.047 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -35.67 75.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.272 -0.893 . . . . 0.0 110.237 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.464 ' O ' ' HB ' ' A' ' 105' ' ' THR . 25.4 m-85 -60.97 -25.88 67.16 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.387 -0.821 . . . . 0.0 110.145 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.939 ' O ' HG22 ' A' ' 105' ' ' THR . . . -74.54 -40.82 61.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.332 -0.855 . . . . 0.0 110.159 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.515 HG13 HD23 ' A' ' 130' ' ' LEU . 3.0 t -74.57 -26.52 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.337 -0.852 . . . . 0.0 110.049 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -88.59 -24.02 22.96 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.303 -0.873 . . . . 0.0 110.405 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.939 HG22 ' O ' ' A' ' 102' ' ' ALA . 14.0 t -61.79 -23.75 66.41 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.129 -0.982 . . . . 0.0 110.147 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.759 HD11 HD22 ' A' ' 64' ' ' LEU . 10.6 mt -70.44 -40.44 73.76 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 110.085 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.493 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 0.1 OUTLIER -47.58 -36.1 10.15 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 110.349 179.969 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -91.37 -23.34 20.1 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.376 -0.827 . . . . 0.0 110.288 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -58.03 119.76 7.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.242 -0.911 . . . . 0.0 110.222 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.432 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 0.0 OUTLIER -160.21 140.86 11.91 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.24 -0.912 . . . . 0.0 110.18 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -161.66 116.43 1.99 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.236 -0.915 . . . . 0.0 110.39 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.94 HG11 ' O ' ' A' ' 117' ' ' LYS . 94.8 t -135.36 62.32 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.26 -0.9 . . . . 0.0 109.996 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 112' ' ' VAL . 3.0 m-20 60.26 178.91 0.09 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.28 -0.887 . . . . 0.0 110.143 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.19 -47.77 54.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.215 -0.928 . . . . 0.0 110.133 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -159.02 70.45 0.49 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.41 -0.806 . . . . 0.0 110.143 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -101.63 -133.22 8.01 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.94 ' O ' HG11 ' A' ' 112' ' ' VAL . 9.9 mtmm -96.54 -150.35 0.33 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.246 -1.15 . . . . 0.0 110.313 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.541 ' HA ' HG21 ' A' ' 112' ' ' VAL . 16.3 t0 -140.78 72.09 1.38 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.291 -0.88 . . . . 0.0 110.143 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.493 ' HG3' ' CZ2' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -94.25 23.51 5.05 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.217 -0.927 . . . . 0.0 110.18 -179.994 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -104.54 15.17 49.95 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.6 p -82.55 -44.13 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.228 -1.16 . . . . 0.0 110.03 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 6.5 t30 -43.29 -45.7 6.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.379 -0.825 . . . . 0.0 110.344 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 1.028 HG22 ' HE1' ' A' ' 78' ' ' MET . 1.2 t -82.2 -37.25 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.196 -0.94 . . . . 0.0 110.059 -179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.493 ' HG3' ' HA ' ' A' ' 107' ' ' LYS . 31.1 ttp180 -53.6 -61.5 2.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.08 -1.012 . . . . 0.0 110.837 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 78.9 mt-10 -65.76 -40.65 92.28 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.351 -0.843 . . . . 0.0 111.259 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.519 ' HG3' ' HB3' ' A' ' 78' ' ' MET . 11.2 tptm -52.68 -51.06 61.89 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.073 -1.017 . . . . 0.0 110.203 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.491 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -58.73 -45.54 89.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.378 -0.826 . . . . 0.0 109.958 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.0 tttm -49.66 -46.41 49.68 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.264 -0.897 . . . . 0.0 109.917 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.64 -51.01 68.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.318 -0.864 . . . . 0.0 110.091 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.928 HD21 ' HG2' ' A' ' 81' ' ' MET . 20.5 tp -47.61 -30.69 3.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.214 -0.929 . . . . 0.0 110.04 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.467 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 28.2 t -81.52 -34.76 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.332 -0.855 . . . . 0.0 110.287 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.438 ' O ' ' N ' ' A' ' 134' ' ' LEU . . . -71.52 -60.36 2.27 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.324 -0.86 . . . . 0.0 110.539 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 132' ' ' ALA . 0.8 OUTLIER -42.1 -26.77 0.11 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 110.387 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 1.015 HD11 HD13 ' A' ' 85' ' ' ILE . 0.3 OUTLIER -89.73 -38.47 13.81 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.279 -0.888 . . . . 0.0 110.211 179.978 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -106.35 47.49 0.88 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.239 -0.913 . . . . 0.0 110.103 179.873 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -79.12 -53.63 6.8 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.285 -0.884 . . . . 0.0 110.312 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -81.22 149.11 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.293 -0.879 . . . . 0.0 110.314 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.4 t70 61.11 42.52 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.272 -0.892 . . . . 0.0 110.394 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -23.29 64.04 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.187 -0.946 . . . . 0.0 110.128 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.48 ' O ' HD23 ' A' ' 140' ' ' LEU . 0.3 OUTLIER -63.5 103.68 0.55 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.209 -0.932 . . . . 0.0 110.179 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.91 61.17 0.61 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.298 -0.876 . . . . 0.0 110.155 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.07 107.87 0.13 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.271 -0.893 . . . . 0.0 110.229 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -129.45 -42.23 1.33 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.209 -0.932 . . . . 0.0 110.229 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.229 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.3 127.17 48.17 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.235 -1.156 . . . . 0.0 110.279 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 1.5 m -143.99 28.3 1.4 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.23 -0.919 . . . . 0.0 110.162 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -164.92 67.19 0.14 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.21 -0.932 . . . . 0.0 110.181 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.61 -4.11 29.13 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 110.207 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.1 p -155.21 -174.3 4.92 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.263 -0.898 . . . . 0.0 110.157 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.676 ' O ' HG23 ' A' ' 3' ' ' THR . 11.6 t -152.58 63.52 0.8 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.171 -0.955 . . . . 0.0 110.137 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -137.44 -171.88 3.08 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.0 110.238 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -137.74 159.25 42.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.278 -0.889 . . . . 0.0 110.012 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 6' ' ' LEU . 10.6 mt 49.33 80.79 0.06 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.172 -0.955 . . . . 0.0 110.076 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -123.39 -19.19 5.99 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.379 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 9' ' ' GLN . 0.0 OUTLIER -171.94 -48.2 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.242 -0.911 . . . . 0.0 110.308 -179.929 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.453 ' C ' ' O ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER 38.92 42.64 0.67 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.392 -0.818 . . . . 0.0 110.85 179.604 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.36 170.16 12.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.148 -0.97 . . . . 0.0 110.036 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.77 -157.34 0.43 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.153 -0.967 . . . . 0.0 110.24 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -149.61 138.24 20.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.368 -0.833 . . . . 0.0 110.094 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.437 ' O ' ' O ' ' A' ' 14' ' ' VAL . 24.0 mt -72.16 152.77 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.114 -0.991 . . . . 0.0 110.162 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.437 ' O ' ' O ' ' A' ' 13' ' ' ILE . 21.5 t -43.45 166.22 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.231 -0.918 . . . . 0.0 110.304 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.418 ' N ' HG12 ' A' ' 14' ' ' VAL . 20.0 m80 -99.58 -31.8 11.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.283 -0.885 . . . . 0.0 110.063 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -91.87 142.12 27.91 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.2 -0.938 . . . . 0.0 110.158 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -72.78 158.18 36.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.186 -0.946 . . . . 0.0 110.241 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -172.71 37.16 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 110.153 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -107.11 34.14 3.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.266 -0.896 . . . . 0.0 110.22 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.694 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -68.55 -41.04 80.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.272 -0.893 . . . . 0.0 110.191 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.475 ' HG3' HG13 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -55.11 -25.86 34.35 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.281 -0.887 . . . . 0.0 110.248 -180.0 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.475 HG13 ' HG3' ' A' ' 21' ' ' GLU . 40.8 mt -80.47 -44.9 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.258 -0.901 . . . . 0.0 110.273 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.533 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 2.1 mtmm -62.75 -32.18 73.26 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.238 -0.914 . . . . 0.0 110.122 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.852 HG21 ' HA ' ' A' ' 56' ' ' ILE . 33.1 t -71.24 -41.32 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.309 -0.869 . . . . 0.0 110.11 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -56.9 -42.49 79.99 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 110.027 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -72.97 -38.15 66.81 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.376 -0.827 . . . . 0.0 110.056 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.795 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -63.96 -22.16 66.8 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.304 -0.873 . . . . 0.0 110.094 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.88 HG22 ' HA ' ' A' ' 77' ' ' ALA . 13.2 p -103.47 35.22 2.66 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.259 -0.901 . . . . 0.0 110.17 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.96 107.4 0.05 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.231 -0.918 . . . . 0.0 110.123 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -119.83 -59.8 1.77 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.251 -0.906 . . . . 0.0 110.253 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.417 ' CB ' ' CD ' ' A' ' 32' ' ' PRO . 0.2 OUTLIER 61.31 -179.95 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.223 -0.923 . . . . 0.0 110.076 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.436 ' O ' ' C ' ' A' ' 33' ' ' TRP . 23.4 Cg_exo -59.4 174.24 1.15 Allowed 'Trans proline' 0 C--N 1.306 -1.683 0 O-C-N 123.987 1.519 . . . . 0.0 110.32 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.436 ' C ' ' O ' ' A' ' 32' ' ' PRO . 0.8 OUTLIER 41.07 -159.14 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.423 -0.798 . . . . 0.0 110.598 179.931 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.79 138.58 4.79 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -68.64 151.8 74.81 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 123.971 1.511 . . . . 0.0 110.402 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.4 m -115.83 149.26 38.88 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.247 -0.908 . . . . 0.0 110.129 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 p -178.58 160.76 1.25 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.935 . . . . 0.0 110.256 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.4 m -60.21 96.92 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.348 -0.845 . . . . 0.0 110.195 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.795 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER -110.48 -10.55 14.55 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.164 -0.96 . . . . 0.0 110.215 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.529 ' CE ' HG22 ' A' ' 79' ' ' THR . 4.2 mmt -86.88 -47.64 8.84 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 110.201 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.485 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 7.2 t -57.87 -19.78 31.88 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.266 -0.896 . . . . 0.0 110.143 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.424 ' OE2' ' HD3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -82.0 -58.13 3.1 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.237 -0.915 . . . . 0.0 110.192 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.653 HG21 HD21 ' A' ' 80' ' ' LEU . 96.4 mt -50.41 -35.56 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.163 -0.961 . . . . 0.0 109.937 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.621 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -67.32 -54.27 22.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.317 -0.864 . . . . 0.0 109.509 179.472 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.1 -21.88 3.65 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.159 -0.963 . . . . 0.0 108.988 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.705 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 14.1 mt -81.73 -37.83 26.68 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.574 -0.704 . . . . 0.0 109.927 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.509 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 80.6 p -49.77 -40.91 42.83 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.071 -1.018 . . . . 0.0 109.243 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.587 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 72.4 m-85 -44.39 -47.09 9.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.233 -0.917 . . . . 0.0 109.317 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.547 ' O ' ' C ' ' A' ' 50' ' ' VAL . 2.8 m120 -70.14 90.71 0.67 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.707 -0.621 . . . . 0.0 110.432 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.547 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.58 -58.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.269 178.099 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.546 ' H ' HG23 ' A' ' 50' ' ' VAL . 2.6 t -61.75 -64.4 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.096 -1.002 . . . . 0.0 109.943 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.705 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.89 -45.24 0.84 Allowed 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.759 -177.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.568 ' CD1' HG22 ' A' ' 92' ' ' VAL . 20.6 t80 -60.99 -53.95 50.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.292 -0.88 . . . . 0.0 110.166 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.52 -30.29 40.82 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.291 -0.88 . . . . 0.0 109.946 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -80.15 -29.38 38.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.428 -0.795 . . . . 0.0 110.01 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.852 ' HA ' HG21 ' A' ' 24' ' ' VAL . 10.3 mt -77.79 -69.63 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.356 -0.84 . . . . 0.0 110.09 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.636 ' HE2' ' HG3' ' A' ' 95' ' ' GLN . 0.2 OUTLIER -45.96 -35.45 4.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.27 -0.894 . . . . 0.0 110.111 179.732 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.5 t -58.36 -66.09 0.54 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.279 -0.888 . . . . 0.0 110.197 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.09 -17.24 16.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.301 -0.875 . . . . 0.0 109.986 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.901 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.7 OUTLIER -79.12 -33.15 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.37 -0.831 . . . . 0.0 109.813 179.809 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.602 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 12.2 m95 -75.74 -41.78 52.39 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.251 -0.905 . . . . 0.0 110.111 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.1 -57.7 11.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.306 -0.871 . . . . 0.0 110.13 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -66.88 -11.57 56.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 110.12 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.923 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 3.7 mt -80.32 -22.19 41.75 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.197 -0.94 . . . . 0.0 110.265 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.408 ' O ' ' O ' ' A' ' 66' ' ' ASP . 2.9 t30 -101.2 36.32 2.02 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.243 -0.911 . . . . 0.0 109.966 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.731 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.2 OUTLIER -57.21 -162.96 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.288 -0.883 . . . . 0.0 110.323 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.0 m80 -101.32 173.73 6.31 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.313 -0.867 . . . . 0.0 110.316 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.501 ' HA3' ' HB2' ' A' ' 111' ' ' TYR . . . -62.22 -68.81 1.51 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.1 ttpm? -51.82 -26.77 10.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.233 -1.157 . . . . 0.0 110.172 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -105.74 45.65 0.96 Allowed 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.281 -0.887 . . . . 0.0 110.312 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.468 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 64.9 p-90 -76.09 -19.62 58.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.176 -0.953 . . . . 0.0 110.238 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -43.98 -49.84 8.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.257 -0.902 . . . . 0.0 110.108 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -54.08 -49.1 69.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 110.2 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.731 HG23 ' HB2' ' A' ' 66' ' ' ASP . 25.0 t -49.48 -49.95 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.325 -0.86 . . . . 0.0 110.278 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.62 ' CE1' ' CD ' ' A' ' 126' ' ' LYS . 6.7 t80 -47.08 -55.25 8.65 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.284 -0.885 . . . . 0.0 110.586 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.527 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -66.88 -23.86 66.05 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.107 -0.996 . . . . 0.0 110.513 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.923 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -68.89 -68.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.234 -0.916 . . . . 0.0 110.378 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.804 ' HE3' HG23 ' A' ' 123' ' ' VAL . 0.3 OUTLIER -49.63 -31.96 11.93 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.381 -0.824 . . . . 0.0 110.192 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.529 HG22 ' CE ' ' A' ' 40' ' ' MET . 95.7 m -55.27 -56.3 21.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.14 -0.975 . . . . 0.0 109.646 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.901 ' CD2' HD11 ' A' ' 60' ' ' ILE . 29.7 tp -51.6 -66.62 0.35 Allowed 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.329 -0.857 . . . . 0.0 108.818 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.602 ' HE1' ' CZ3' ' A' ' 61' ' ' TRP . 47.3 ttm -41.32 -28.49 0.11 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.444 -0.785 . . . . 0.0 110.418 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.481 ' CB ' HD12 ' A' ' 130' ' ' LEU . 0.2 OUTLIER -72.3 -47.08 52.71 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.21 -0.931 . . . . 0.0 110.529 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.591 ' CE1' HG21 ' A' ' 87' ' ' THR . 33.6 t80 -70.54 -30.53 67.29 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.236 -0.915 . . . . 0.0 111.355 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.933 ' HB2' HG11 ' A' ' 92' ' ' VAL . 6.7 mt -75.26 -33.29 61.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.941 -1.1 . . . . 0.0 110.521 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.025 HG21 HD11 ' A' ' 134' ' ' LEU . 53.7 mt -62.15 -29.76 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 120.995 -1.065 . . . . 0.0 110.352 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.7 tttt -85.89 -71.13 0.55 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.245 -0.909 . . . . 0.0 110.541 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.591 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.0 t -94.34 -20.43 19.76 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.198 -0.938 . . . . 0.0 110.446 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.621 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -49.32 -66.4 2.25 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 3.5 t 171.98 158.21 0.09 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.099 -1.236 . . . . 0.0 110.256 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -63.46 -12.91 35.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.293 -0.879 . . . . 0.0 110.263 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.464 ' HD3' ' O ' ' A' ' 47' ' ' THR . 3.9 ptm85 -84.67 -29.18 25.86 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -0.903 . . . . 0.0 110.237 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.933 HG11 ' HB2' ' A' ' 84' ' ' LEU . 59.9 t -67.65 -31.46 52.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.194 -0.941 . . . . 0.0 109.818 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 83.7 p -80.0 -39.19 30.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.324 -0.86 . . . . 0.0 109.712 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -61.58 -51.23 69.41 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.309 -0.87 . . . . 0.0 109.773 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.636 ' HG3' ' HE2' ' A' ' 57' ' ' MET . 5.3 tp-100 -57.67 -40.1 78.58 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.455 -0.778 . . . . 0.0 109.536 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 8.5 t -55.62 -37.87 68.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -0.873 . . . . 0.0 109.54 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.93 -32.61 67.5 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.437 -0.789 . . . . 0.0 109.705 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -71.16 -24.09 62.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.443 -0.786 . . . . 0.0 109.801 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -123.76 36.04 4.71 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.44 -0.788 . . . . 0.0 110.106 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.461 ' O ' HG12 ' A' ' 103' ' ' VAL . 0.3 OUTLIER -59.69 -20.67 57.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.333 -0.854 . . . . 0.0 110.271 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.449 ' O ' ' HB ' ' A' ' 105' ' ' THR . 55.1 m-85 -76.24 -28.46 57.16 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.193 -0.942 . . . . 0.0 110.227 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.861 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.71 -39.03 53.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 110.222 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.579 ' CG1' ' N ' ' A' ' 104' ' ' GLN . 3.2 p -74.71 -42.03 47.75 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 CA-C-O 121.942 0.877 . . . . 0.0 109.08 179.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.717 ' OE1' HG21 ' A' ' 131' ' ' VAL . 14.3 mm100 -70.04 -21.78 63.15 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.556 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.861 HG22 ' O ' ' A' ' 102' ' ' ALA . 4.7 t -57.47 -16.08 8.64 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.986 -1.072 . . . . 0.0 109.994 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.76 HD11 HD22 ' A' ' 64' ' ' LEU . 76.4 mt -74.99 -37.42 61.87 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.263 -0.898 . . . . 0.0 110.382 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.495 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 2.8 pttp -54.47 -18.3 4.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.223 -0.923 . . . . 0.0 110.136 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.438 ' OD2' ' HE3' ' A' ' 107' ' ' LYS . 57.6 m-20 -117.68 -12.32 10.29 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.225 -0.922 . . . . 0.0 110.222 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.441 ' CZ ' ' O ' ' A' ' 66' ' ' ASP . 0.3 OUTLIER -68.49 97.25 0.75 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.305 -0.872 . . . . 0.0 110.321 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -135.98 156.33 48.9 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.262 -0.899 . . . . 0.0 110.076 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.501 ' HB2' ' HA3' ' A' ' 68' ' ' GLY . 0.3 OUTLIER -165.13 107.54 0.82 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.234 -0.917 . . . . 0.0 110.251 -179.926 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 12.9 t -127.23 43.53 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.283 -0.886 . . . . 0.0 110.185 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 52.95 -176.48 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.275 -0.891 . . . . 0.0 110.214 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.78 -46.42 59.52 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.229 -0.92 . . . . 0.0 110.242 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -154.69 110.63 3.19 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.158 -0.964 . . . . 0.0 110.272 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -148.4 -154.17 6.21 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -96.74 130.23 44.01 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.215 -1.168 . . . . 0.0 110.124 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' A' ' 118' ' ' ASP . 19.2 p-10 -62.56 113.7 3.12 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.273 -0.892 . . . . 0.0 110.401 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -130.57 38.62 3.71 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.256 -0.902 . . . . 0.0 110.136 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -120.22 6.83 11.79 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.646 -1.381 . . . . 0.0 109.646 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.557 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.4 p -74.65 -42.49 48.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.23 -1.159 . . . . 0.0 109.954 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.557 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 37.8 m-80 -47.77 -60.32 2.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.434 -0.791 . . . . 0.0 110.282 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.804 HG23 ' HE3' ' A' ' 78' ' ' MET . 14.9 p -72.46 -13.09 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.245 -0.909 . . . . 0.0 110.494 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.509 ' HB3' ' HA ' ' A' ' 121' ' ' VAL . 6.4 ttt180 -74.25 -69.02 0.47 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.14 -0.975 . . . . 0.0 110.563 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.46 -34.92 71.39 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.327 -0.858 . . . . 0.0 110.644 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.62 ' CD ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -58.31 -56.56 20.51 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.036 -1.04 . . . . 0.0 109.885 179.978 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.762 ' HB2' ' HE1' ' A' ' 78' ' ' MET . . . -54.5 -44.88 73.1 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 109.93 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.42 ' HE3' ' HD2' ' A' ' 107' ' ' LYS . 11.2 mtpt -57.29 -35.13 69.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.272 -0.893 . . . . 0.0 110.244 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.438 ' O ' ' HB3' ' A' ' 132' ' ' ALA . 5.2 tt0 -59.44 -48.29 82.22 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.295 -0.878 . . . . 0.0 110.422 -179.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.589 HD21 ' CD1' ' A' ' 85' ' ' ILE . 3.8 tt -55.19 -51.63 65.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.197 -0.939 . . . . 0.0 110.264 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.717 HG21 ' OE1' ' A' ' 104' ' ' GLN . 96.0 t -63.75 -26.89 41.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.423 -0.798 . . . . 0.0 110.387 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 129' ' ' GLN . . . -64.97 -47.03 79.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.278 -0.889 . . . . 0.0 110.186 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 mt -58.01 -48.87 78.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.265 -0.897 . . . . 0.0 110.406 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 1.025 HD11 HG21 ' A' ' 85' ' ' ILE . 9.6 mp -67.68 -15.62 63.74 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.218 -0.926 . . . . 0.0 110.383 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.8 ttt-85 -110.66 51.8 0.75 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.182 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.47 ' O ' ' CB ' ' A' ' 137' ' ' GLU . 0.8 OUTLIER -152.18 -61.94 0.16 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.212 -0.93 . . . . 0.0 110.217 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.47 ' CB ' ' O ' ' A' ' 136' ' ' ASP . 0.0 OUTLIER 66.74 147.09 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.242 -0.911 . . . . 0.0 110.25 179.991 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.04 168.58 20.79 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.21 -0.931 . . . . 0.0 110.237 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.3 ptt180 -59.6 148.63 32.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.24 -0.912 . . . . 0.0 110.151 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -98.69 81.75 2.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.228 -0.92 . . . . 0.0 110.341 179.992 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.91 60.58 0.86 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.335 -0.853 . . . . 0.0 110.146 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -158.12 151.99 23.89 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.223 -0.923 . . . . 0.0 110.27 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -144.29 -69.12 0.31 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.197 -0.939 . . . . 0.0 110.246 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 118.045 -0.979 . . . . 0.0 110.21 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.27 61.34 1.68 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.224 -1.162 . . . . 0.0 110.22 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 69.2 m -96.79 29.93 2.84 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.259 -0.901 . . . . 0.0 110.171 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -77.14 -158.78 0.11 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.249 -0.907 . . . . 0.0 110.339 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ttp -89.7 -28.85 19.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.276 -0.89 . . . . 0.0 110.116 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.54 157.09 22.48 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.271 -0.893 . . . . 0.0 110.252 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.78 83.56 2.18 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.234 -0.916 . . . . 0.0 110.2 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.0 p -119.41 68.77 0.82 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.298 -0.876 . . . . 0.0 110.208 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.25 -62.84 1.39 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.293 -0.879 . . . . 0.0 110.287 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.416 ' C ' HD23 ' A' ' 6' ' ' LEU . 3.1 tt -148.54 109.76 4.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.25 -0.907 . . . . 0.0 110.367 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -114.69 135.37 54.24 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.237 -0.915 . . . . 0.0 110.224 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -121.64 -76.97 0.58 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.267 -0.896 . . . . 0.0 110.173 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -75.89 117.55 17.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.312 -0.868 . . . . 0.0 110.239 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.483 ' O ' ' C ' ' A' ' 11' ' ' LYS . 11.7 tpt -72.75 -54.03 10.02 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.36 -0.838 . . . . 0.0 110.174 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.502 ' HG3' ' N ' ' A' ' 12' ' ' ASN . 2.4 pttt 33.34 -143.92 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.773 -0.579 . . . . 0.0 111.197 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.502 ' N ' ' HG3' ' A' ' 11' ' ' LYS . 0.9 OUTLIER 59.96 45.9 11.65 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.224 -0.922 . . . . 0.0 109.982 -179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.5 tt -103.13 -175.32 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.255 -0.903 . . . . 0.0 110.167 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.3 m -119.37 141.56 38.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.218 -0.926 . . . . 0.0 110.423 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -104.72 8.98 35.21 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.235 -0.916 . . . . 0.0 110.128 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.82 63.21 1.71 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.317 -0.864 . . . . 0.0 110.163 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -70.17 176.75 3.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.348 -0.845 . . . . 0.0 110.201 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.2 t 50.09 70.2 0.53 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.347 -0.846 . . . . 0.0 110.252 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.431 ' HB2' HD12 ' A' ' 22' ' ' ILE . 2.7 pt-20 -132.01 15.64 4.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.251 -0.905 . . . . 0.0 110.188 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.85 ' HB2' HD13 ' A' ' 46' ' ' LEU . . . -54.16 -46.12 72.23 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 110.115 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 3.1 pt-20 -41.87 -46.73 4.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.387 -0.821 . . . . 0.0 110.418 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.435 HG13 ' HG3' ' A' ' 21' ' ' GLU . 63.3 mt -63.13 -44.21 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.223 -0.923 . . . . 0.0 110.023 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.526 ' CG ' HD21 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -57.22 -32.74 66.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.289 -0.882 . . . . 0.0 110.103 179.775 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.901 HG22 HD21 ' A' ' 80' ' ' LEU . 28.2 t -71.72 -28.06 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.148 -0.97 . . . . 0.0 110.018 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -45.32 64.04 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.204 -0.935 . . . . 0.0 109.985 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.435 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -78.54 -22.53 47.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.328 -0.857 . . . . 0.0 110.022 179.85 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.457 ' HB2' HD22 ' A' ' 39' ' ' LEU . . . -77.26 -21.98 52.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.294 -0.879 . . . . 0.0 110.218 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.444 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 25.2 p -92.93 39.63 1.04 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.225 -0.922 . . . . 0.0 110.199 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -172.97 -165.46 0.3 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.249 -0.907 . . . . 0.0 110.213 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -165.73 166.69 17.69 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.219 -0.925 . . . . 0.0 110.194 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -125.72 158.71 64.24 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 121.271 -0.893 . . . . 0.0 110.246 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.413 ' O ' ' HB2' ' A' ' 33' ' ' TRP . 20.0 Cg_endo -66.68 -173.95 0.42 Allowed 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.037 1.546 . . . . 0.0 110.391 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.413 ' HB2' ' O ' ' A' ' 32' ' ' PRO . 6.1 m95 60.19 -92.89 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.274 -0.891 . . . . 0.0 110.529 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -129.36 93.58 0.34 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -65.42 122.02 9.6 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.022 1.538 . . . . 0.0 110.337 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.4 130.65 47.11 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.175 -0.953 . . . . 0.0 110.18 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.2 t -124.98 83.87 2.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.258 -0.901 . . . . 0.0 110.203 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.8 t -172.76 54.15 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.33 -0.856 . . . . 0.0 110.239 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.587 HD22 HD11 ' A' ' 43' ' ' ILE . 0.8 OUTLIER -127.53 -4.14 6.0 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.257 -0.902 . . . . 0.0 110.137 179.998 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.555 ' HG2' ' CG ' ' A' ' 83' ' ' TYR . 0.2 OUTLIER -77.97 -56.52 4.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.235 -0.915 . . . . 0.0 110.182 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.7 t -62.73 -29.89 71.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.271 -0.893 . . . . 0.0 110.386 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.47 -60.46 2.3 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.168 -0.957 . . . . 0.0 110.467 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.67 HG21 HD11 ' A' ' 80' ' ' LEU . 15.8 mt -50.39 -31.65 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.222 -0.924 . . . . 0.0 110.301 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.569 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -70.66 -51.31 28.69 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.071 -1.018 . . . . 0.0 109.418 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.499 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.5 OUTLIER -53.96 -20.6 6.43 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.102 -0.999 . . . . 0.0 108.892 178.895 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.85 HD13 ' HB2' ' A' ' 20' ' ' ALA . 20.4 mt -81.13 -37.02 29.54 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.535 -0.728 . . . . 0.0 109.954 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.506 ' O ' ' HB2' ' A' ' 53' ' ' PHE . 80.7 p -53.04 -42.87 66.14 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.099 -1.001 . . . . 0.0 109.099 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.499 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 93.1 m-85 -44.37 -42.22 6.71 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.267 -0.896 . . . . 0.0 109.511 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.532 ' O ' ' N ' ' A' ' 51' ' ' VAL . 5.3 m-80 -73.19 92.64 1.76 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.483 -0.761 . . . . 0.0 110.187 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.526 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.39 -57.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.657 178.343 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.542 HG12 ' N ' ' A' ' 52' ' ' ALA . 3.0 t -65.82 -66.38 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.963 -1.086 . . . . 0.0 110.482 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.725 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -36.01 -45.31 0.42 Allowed 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.161 0.505 . . . . 0.0 111.08 -177.582 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.636 ' CD1' HG22 ' A' ' 92' ' ' VAL . 6.0 t80 -55.68 -58.85 6.08 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.307 -0.871 . . . . 0.0 110.393 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.486 ' O ' ' HB2' ' A' ' 58' ' ' SER . 18.2 m -51.1 -42.03 60.38 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.165 -0.959 . . . . 0.0 110.44 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 1.5 mm-40 -66.33 -30.96 71.48 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.198 -0.939 . . . . 0.0 110.505 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.744 ' HA ' HG21 ' A' ' 24' ' ' VAL . 7.1 mt -74.23 -70.01 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.334 -0.854 . . . . 0.0 110.359 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.419 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 52.6 mmm -46.7 -38.27 9.62 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.131 -0.981 . . . . 0.0 110.128 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.486 ' HB2' ' O ' ' A' ' 54' ' ' SER . 23.2 t -52.7 -60.68 2.96 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.252 -0.905 . . . . 0.0 110.26 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.55 ' HB3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -58.23 -31.47 67.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.142 -0.974 . . . . 0.0 109.858 179.793 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.7 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -66.92 -29.59 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.411 -0.806 . . . . 0.0 109.917 179.883 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.548 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 19.7 m95 -79.39 -41.67 27.22 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.247 -0.908 . . . . 0.0 110.434 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.53 -66.3 0.46 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.249 -0.907 . . . . 0.0 110.636 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -61.37 -23.9 66.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.916 . . . . 0.0 110.606 -179.602 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.868 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 3.8 mt -60.78 -27.34 67.92 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.151 -0.968 . . . . 0.0 110.337 -179.732 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.407 ' O ' ' C ' ' A' ' 66' ' ' ASP . 11.5 t30 -103.48 37.3 2.04 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.286 -0.883 . . . . 0.0 110.014 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.673 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.4 OUTLIER -41.97 156.59 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.423 -0.798 . . . . 0.0 110.286 -179.888 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.73 -171.55 0.07 Allowed 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.636 -0.665 . . . . 0.0 110.128 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -93.68 58.07 2.22 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.1 ttpp -137.18 -37.31 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.165 -1.197 . . . . 0.0 110.368 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -151.72 107.91 3.42 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.3 -0.875 . . . . 0.0 110.414 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.55 ' HB2' HG21 ' A' ' 123' ' ' VAL . 33.1 p-90 -78.29 -5.53 52.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.294 -0.879 . . . . 0.0 110.272 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -45.92 -46.76 16.24 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.298 -0.876 . . . . 0.0 110.285 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -59.81 -40.01 86.98 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.234 -0.916 . . . . 0.0 110.258 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.837 HG12 ' HE2' ' A' ' 78' ' ' MET . 49.6 t -62.02 -57.32 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.172 -0.955 . . . . 0.0 110.272 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 74' ' ' VAL . 4.6 t80 -42.38 -54.54 3.76 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.299 -0.875 . . . . 0.0 110.315 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.444 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -61.11 -36.69 80.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.19 -0.944 . . . . 0.0 110.263 179.932 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.868 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -62.41 -25.87 68.18 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.235 -0.916 . . . . 0.0 110.159 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.837 ' HE2' HG12 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -78.57 -35.32 46.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.198 -0.939 . . . . 0.0 110.177 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 25.6 m -60.26 -55.26 35.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 0.0 109.997 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.901 HD21 HG22 ' A' ' 24' ' ' VAL . 25.5 tp -59.91 -34.63 73.46 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.456 -0.778 . . . . 0.0 109.964 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.65 ' CE ' HD11 ' A' ' 64' ' ' LEU . 15.9 ttm -66.39 -33.74 76.4 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.137 -0.977 . . . . 0.0 110.122 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.746 ' HB2' HD12 ' A' ' 130' ' ' LEU . 3.7 tp10 -77.74 -63.83 1.29 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.295 -0.878 . . . . 0.0 110.144 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.742 ' CE1' HG21 ' A' ' 87' ' ' THR . 54.0 t80 -41.27 -49.65 3.66 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.418 -0.801 . . . . 0.0 110.641 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.535 ' CB ' HG11 ' A' ' 92' ' ' VAL . 81.6 mt -64.72 -43.78 92.32 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.311 -0.868 . . . . 0.0 110.337 -179.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.931 HD11 ' SG ' ' A' ' 96' ' ' CYS . 13.5 mt -49.69 -25.98 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.086 -1.009 . . . . 0.0 109.768 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.8 mttp -97.18 -81.36 0.43 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 110.053 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.742 HG21 ' CE1' ' A' ' 83' ' ' TYR . 13.0 t -72.64 -24.67 61.08 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.301 -0.874 . . . . 0.0 110.271 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.445 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -47.22 -77.23 0.11 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.451 ' HB3' HG23 ' A' ' 92' ' ' VAL . 26.7 t -179.17 155.98 0.75 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.159 -1.2 . . . . 0.0 110.326 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -56.91 -17.79 10.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.288 -0.882 . . . . 0.0 110.177 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -83.25 -37.07 24.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.323 -0.86 . . . . 0.0 110.175 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.636 HG22 ' CD1' ' A' ' 53' ' ' PHE . 59.2 t -59.92 -32.14 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.292 -0.88 . . . . 0.0 110.085 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.0 t -79.01 -40.75 30.63 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.0 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.527 ' O ' ' CG ' ' A' ' 97' ' ' LYS . 38.9 mt-30 -65.58 -26.14 67.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 109.867 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -35.91 60.91 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.244 -0.91 . . . . 0.0 109.519 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.931 ' SG ' HD11 ' A' ' 85' ' ' ILE . 1.3 m -65.61 -37.9 87.92 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.33 -0.856 . . . . 0.0 109.669 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.527 ' CG ' ' O ' ' A' ' 94' ' ' GLN . 0.2 OUTLIER -72.8 -28.14 62.4 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.339 -0.851 . . . . 0.0 109.596 179.349 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.507 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 7.7 mm-40 -75.32 -29.99 60.17 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.368 -0.832 . . . . 0.0 109.348 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.408 ' OD1' ' HB2' ' A' ' 102' ' ' ALA . 22.1 t-20 -116.66 44.38 2.04 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.502 -0.749 . . . . 0.0 109.583 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.41 ' CE ' ' HD2' ' A' ' 135' ' ' ARG . 0.0 OUTLIER -61.32 -29.27 69.78 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.431 -0.793 . . . . 0.0 110.259 -179.864 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.483 ' O ' ' HB ' ' A' ' 105' ' ' THR . 57.9 m-85 -66.44 -24.92 66.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.205 -0.934 . . . . 0.0 109.779 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.898 ' O ' HG22 ' A' ' 105' ' ' THR . . . -77.47 -41.32 39.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.462 -0.774 . . . . 0.0 110.112 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.599 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 4.0 t -72.33 -31.01 37.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.356 -0.84 . . . . 0.0 110.156 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.497 ' O ' ' CG ' ' A' ' 107' ' ' LYS . 2.2 mm100 -86.91 -19.41 28.89 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 110.426 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.898 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.6 t -54.7 -18.9 5.17 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.931 . . . . 0.0 109.927 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.619 HD22 HG11 ' A' ' 74' ' ' VAL . 91.3 mt -79.41 -35.65 40.31 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.389 -0.819 . . . . 0.0 110.118 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.593 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -52.54 -18.98 1.97 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.263 -0.898 . . . . 0.0 110.32 179.937 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.471 ' OD1' ' HD2' ' A' ' 107' ' ' LYS . 49.4 m-20 -103.06 -28.96 11.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.209 -0.932 . . . . 0.0 110.463 -179.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.415 ' C ' ' O ' ' A' ' 108' ' ' ASP . 0.1 OUTLIER -43.72 105.47 0.05 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.142 -0.974 . . . . 0.0 110.269 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -145.54 125.94 14.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.316 -0.865 . . . . 0.0 110.164 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -133.37 110.23 9.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.223 -0.923 . . . . 0.0 110.143 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.493 ' O ' HG12 ' A' ' 112' ' ' VAL . 22.5 t -140.38 46.63 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.225 -0.922 . . . . 0.0 110.495 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -93.77 -83.63 0.32 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.19 -0.944 . . . . 0.0 110.102 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.464 ' HD2' ' OD1' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -54.98 -47.55 74.44 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.234 -0.916 . . . . 0.0 110.486 179.944 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.464 ' OD1' ' HD2' ' A' ' 114' ' ' ARG . 59.3 m-20 -68.86 -91.02 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.991 . . . . 0.0 110.324 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.449 ' O ' ' O ' ' A' ' 117' ' ' LYS . . . 134.94 157.2 7.96 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.449 ' O ' ' O ' ' A' ' 116' ' ' GLY . 0.2 OUTLIER 60.78 132.08 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.276 -1.132 . . . . 0.0 110.214 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -80.51 128.07 33.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.266 -0.896 . . . . 0.0 110.221 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.455 ' CG ' ' N ' ' A' ' 120' ' ' GLY . 18.8 pt20 -127.59 -36.79 2.03 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.215 -0.928 . . . . 0.0 110.27 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.455 ' N ' ' CG ' ' A' ' 119' ' ' GLN . . . -63.66 91.3 0.09 OUTLIER Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.558 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.3 p -129.43 -42.93 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 O-C-N 121.254 -1.145 . . . . 0.0 110.148 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.558 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 6.0 t30 -39.19 -31.77 0.08 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.66 -0.65 . . . . 0.0 110.361 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.629 HG13 ' HE1' ' A' ' 78' ' ' MET . 2.3 t -83.49 -52.62 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.304 -0.872 . . . . 0.0 109.93 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.593 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 4.4 mtp180 -44.79 -43.67 8.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.142 -0.974 . . . . 0.0 111.176 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -79.33 -46.15 18.25 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.195 -0.94 . . . . 0.0 111.769 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LYS . . . . . 0.543 ' CD ' ' HB2' ' A' ' 78' ' ' MET . 0.0 OUTLIER -53.66 -54.92 30.88 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.919 -1.113 . . . . 0.0 110.109 -179.511 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.81 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -55.46 -44.22 76.21 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.437 -0.789 . . . . 0.0 110.396 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -58.85 -34.66 71.83 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.168 -0.958 . . . . 0.0 110.5 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -69.41 -53.54 18.85 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.227 -0.921 . . . . 0.0 110.78 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.762 HD21 ' CD1' ' A' ' 85' ' ' ILE . 3.3 tt -47.35 -33.66 6.06 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.09 -1.006 . . . . 0.0 110.416 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.486 HG21 ' HG2' ' A' ' 104' ' ' GLN . 44.8 t -77.26 -35.38 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.252 -0.905 . . . . 0.0 110.333 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.19 -49.53 75.7 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -0.91 . . . . 0.0 110.694 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.1 mt -60.93 -56.83 16.52 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.157 -0.965 . . . . 0.0 110.467 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.821 HD11 HD13 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -52.53 -21.96 4.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.18 -0.95 . . . . 0.0 110.284 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.41 ' HD2' ' CE ' ' A' ' 100' ' ' MET . 29.1 ttt85 -132.12 82.76 2.04 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.332 -0.855 . . . . 0.0 110.264 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -147.16 -57.62 0.26 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.256 -0.903 . . . . 0.0 110.244 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.91 166.07 24.95 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.234 -0.916 . . . . 0.0 110.309 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -129.98 174.66 9.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.274 -0.891 . . . . 0.0 110.104 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.09 68.12 0.99 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.259 -0.9 . . . . 0.0 110.3 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.7 mt -68.23 171.42 7.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.916 . . . . 0.0 110.056 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -113.99 80.71 1.42 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.238 -0.914 . . . . 0.0 110.194 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -133.31 -62.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.267 -0.895 . . . . 0.0 110.037 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -125.4 -46.94 1.75 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.923 . . . . 0.0 110.206 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.249 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.231 0.539 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.721 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -68.37 -52.31 34.57 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.237 -0.914 . . . . 0.0 110.309 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.438 ' C ' ' O ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -41.05 -34.03 0.39 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.287 -0.883 . . . . 0.0 110.601 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.1 mm -77.88 -41.86 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.095 -1.003 . . . . 0.0 109.964 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.534 ' HE2' ' CG ' ' A' ' 42' ' ' GLU . 13.3 tptt -61.55 -58.65 7.26 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.253 -0.904 . . . . 0.0 109.934 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.868 HG21 ' HA ' ' A' ' 56' ' ' ILE . 53.7 t -45.45 -55.11 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.407 -0.808 . . . . 0.0 110.385 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.405 ' HG3' ' NH2' ' A' ' 63' ' ' ARG . 18.8 ttt180 -52.69 -63.36 1.17 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.913 . . . . 0.0 110.653 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -14.05 5.44 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.401 -0.812 . . . . 0.0 110.714 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.923 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -86.55 -33.44 20.25 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.134 -0.979 . . . . 0.0 110.328 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.519 ' CA ' ' HB3' ' A' ' 76' ' ' LYS . 19.8 p . . . . . 0 N--CA 1.49 1.551 0 O-C-N 121.288 -0.883 . . . . 0.0 110.119 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.923 HD23 ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.314 0.578 . . . . 0.0 110.231 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.405 ' HA ' HD12 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -55.18 -45.02 75.76 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.131 -0.98 . . . . 0.0 110.141 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.405 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 15.6 t -59.72 -29.59 68.22 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.331 -0.855 . . . . 0.0 110.272 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.534 ' CG ' ' HE2' ' A' ' 23' ' ' LYS . 22.0 mm-40 -70.43 -52.06 24.92 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.255 -0.903 . . . . 0.0 110.286 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.774 HD13 ' CD1' ' A' ' 80' ' ' LEU . 7.2 mt -54.24 -35.54 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.183 -0.948 . . . . 0.0 109.992 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.665 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -67.78 -52.21 39.81 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.31 -0.869 . . . . 0.0 109.486 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.485 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 10.8 t0 -53.91 -20.23 5.74 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.087 -1.008 . . . . 0.0 109.187 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.721 HD22 ' HB2' ' A' ' 20' ' ' ALA . 8.5 mt -82.7 -38.11 23.83 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.523 -0.736 . . . . 0.0 110.093 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.532 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 72.3 p -51.82 -42.5 62.56 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.243 -0.911 . . . . 0.0 109.377 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.547 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 86.3 m-85 -43.63 -44.56 6.4 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.712 -0.795 . . . . 0.0 109.259 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.463 ' O ' ' O ' ' A' ' 48' ' ' TYR . 2.4 t-20 -56.68 -157.48 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.865 0.84 . . . . 0.0 110.298 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.6 t -125.97 -34.56 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -178.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.559 HG12 ' N ' ' A' ' 52' ' ' ALA . 11.2 t -84.54 -71.91 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 CA-C-O 121.967 0.889 . . . . 0.0 109.84 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.559 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -37.92 -40.79 0.49 Allowed 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.737 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.653 ' HA ' HD12 ' A' ' 56' ' ' ILE . 8.1 t80 -54.54 -56.4 19.33 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.425 -0.797 . . . . 0.0 110.214 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 58' ' ' SER . 3.5 m -58.87 -34.96 72.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.301 -0.874 . . . . 0.0 110.251 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.65 -20.02 60.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.279 -0.888 . . . . 0.0 110.04 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.868 ' HA ' HG21 ' A' ' 24' ' ' VAL . 36.6 mt -80.96 -70.07 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 110.135 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.5 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 70.5 mmm -52.01 -36.06 48.72 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.25 -0.906 . . . . 0.0 109.909 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 54' ' ' SER . 3.5 m -57.02 -62.69 1.57 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.308 -0.87 . . . . 0.0 110.147 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -25.32 61.06 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 109.894 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.823 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -72.86 -31.34 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.384 -0.823 . . . . 0.0 109.789 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.57 ' CH2' ' SD ' ' A' ' 81' ' ' MET . 14.9 m95 -72.9 -39.84 66.03 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.274 -0.892 . . . . 0.0 110.307 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -58.9 5.81 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.89 . . . . 0.0 110.211 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.405 ' NH2' ' HG3' ' A' ' 25' ' ' ARG . 18.3 mmt180 -63.58 -11.76 27.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.283 -0.885 . . . . 0.0 110.255 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.995 HD22 HD11 ' A' ' 106' ' ' LEU . 4.7 mt -80.17 -24.97 40.0 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.299 -0.876 . . . . 0.0 110.337 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 . . . . . 0 C--N 1.303 -1.428 0 O-C-N 121.352 -0.842 . . . . 0.0 109.949 -179.809 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.474 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 69.3 p-90 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.165 0.507 . . . . 0.0 110.178 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -48.21 -45.53 34.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.206 -0.934 . . . . 0.0 109.985 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.408 ' ND1' ' N ' ' A' ' 73' ' ' HIS . 2.8 m-70 -61.64 -36.57 81.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.311 -0.868 . . . . 0.0 109.924 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.68 HG22 ' O ' ' A' ' 64' ' ' LEU . 16.4 t -63.1 -57.24 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.304 -0.873 . . . . 0.0 110.021 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.585 ' CE1' ' HD3' ' A' ' 126' ' ' LYS . 7.0 t80 -49.2 -49.11 44.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 109.928 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.519 ' HB3' ' CA ' ' A' ' 28' ' ' THR . 4.5 tptt -62.07 -31.85 72.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.339 -0.851 . . . . 0.0 109.843 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.809 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -69.96 -28.02 65.21 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.349 -0.844 . . . . 0.0 109.908 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.562 ' HG2' HD21 ' A' ' 64' ' ' LEU . 0.7 OUTLIER -73.34 -30.83 63.6 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.387 -0.82 . . . . 0.0 110.183 179.862 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.4 m -70.79 -36.66 73.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.214 -0.929 . . . . 0.0 109.97 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.823 ' CD2' HD11 ' A' ' 60' ' ' ILE . 42.0 tp -77.11 -31.4 55.8 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.318 -0.864 . . . . 0.0 109.677 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.57 ' SD ' ' CH2' ' A' ' 61' ' ' TRP . 31.0 ttp -76.71 -28.12 55.74 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.395 -0.815 . . . . 0.0 109.882 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.548 ' HB2' HD11 ' A' ' 130' ' ' LEU . 26.9 tt0 -85.33 -34.97 21.72 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.262 -0.899 . . . . 0.0 110.026 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.405 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 31.8 t80 -70.58 -45.34 65.57 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.309 -0.87 . . . . 0.0 110.257 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.581 HD11 HG21 ' A' ' 43' ' ' ILE . 50.7 mt -67.46 -40.41 85.36 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.274 -0.892 . . . . 0.0 110.16 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.933 HD13 HD11 ' A' ' 134' ' ' LEU . 26.5 mt -56.75 -20.72 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 109.973 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 -82.4 0.41 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.24 -0.913 . . . . 0.0 110.013 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.422 HG23 ' HB1' ' A' ' 44' ' ' ALA . 7.6 t -76.6 -25.9 54.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.293 -0.879 . . . . 0.0 110.149 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.665 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -44.24 -69.58 0.69 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.434 ' HB3' ' HG2' ' A' ' 91' ' ' ARG . 0.1 OUTLIER 176.61 176.16 0.31 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.224 -1.162 . . . . 0.0 110.215 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -79.12 -15.18 58.51 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 110.257 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.451 ' HD3' ' O ' ' A' ' 47' ' ' THR . 2.2 ptm180 -82.84 -28.59 30.02 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.132 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.5 HG21 HG21 ' A' ' 47' ' ' THR . 95.0 t -69.25 -31.18 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.198 -0.938 . . . . 0.0 109.628 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 85' ' ' ILE . 74.5 m -78.81 -35.85 43.58 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.308 -0.87 . . . . 0.0 109.623 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.58 -41.11 98.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.381 -0.824 . . . . 0.0 109.714 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.21 -35.71 81.9 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.442 -0.786 . . . . 0.0 109.489 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.918 ' SG ' HD13 ' A' ' 134' ' ' LEU . 35.2 t -60.14 -39.8 87.6 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.436 -0.79 . . . . 0.0 109.676 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -33.09 69.24 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.437 -0.789 . . . . 0.0 109.776 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -78.15 -17.73 56.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.389 -0.819 . . . . 0.0 109.903 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -124.45 37.97 4.29 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.46 -0.775 . . . . 0.0 109.928 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -60.19 -29.06 68.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.307 -0.871 . . . . 0.0 110.192 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -64.89 -28.06 69.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.274 -0.892 . . . . 0.0 109.899 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.982 ' O ' HG22 ' A' ' 105' ' ' THR . . . -75.68 -42.79 50.21 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.378 -0.826 . . . . 0.0 110.042 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.543 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 3.3 t -71.75 -26.56 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.344 -0.847 . . . . 0.0 110.175 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -85.31 -27.72 25.75 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.329 -0.857 . . . . 0.0 110.311 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.982 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.4 t -56.58 -17.0 7.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.313 -0.867 . . . . 0.0 110.037 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.995 HD11 HD22 ' A' ' 64' ' ' LEU . 17.4 mt -80.12 -40.73 26.87 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.286 -0.884 . . . . 0.0 110.097 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 124' ' ' ARG . 13.6 ttpt . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.217 -0.927 . . . . 0.0 110.077 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.56 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.3 p . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 121.335 0.588 . . . . 0.0 110.169 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.56 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.9 OUTLIER -44.41 -37.17 3.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.367 -0.833 . . . . 0.0 109.9 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.613 ' CG2' HG12 ' A' ' 74' ' ' VAL . 8.5 p -79.75 -38.01 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.509 ' N ' HG13 ' A' ' 123' ' ' VAL . 5.1 ttp180 -54.9 -55.41 30.82 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.242 -0.911 . . . . 0.0 110.394 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -67.94 -28.68 67.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.411 -0.806 . . . . 0.0 110.529 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.585 ' HD3' ' CE1' ' A' ' 75' ' ' TYR . 2.3 tptt -60.51 -58.77 7.09 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.179 -0.951 . . . . 0.0 109.899 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.543 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -54.99 -42.67 72.77 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.395 -0.816 . . . . 0.0 110.099 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.67 -35.34 74.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.244 -0.91 . . . . 0.0 110.165 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -65.13 -52.64 54.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.3 -0.875 . . . . 0.0 110.464 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.97 ' O ' HD12 ' A' ' 134' ' ' LEU . 0.1 OUTLIER -48.54 -39.56 23.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.218 -0.926 . . . . 0.0 110.443 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 11.8 t -77.32 -30.8 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.231 -0.918 . . . . 0.0 110.323 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.25 -56.67 12.98 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.204 -0.935 . . . . 0.0 110.172 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.4 mp -58.96 -53.12 61.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.263 -0.898 . . . . 0.0 110.31 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.97 HD12 ' O ' ' A' ' 130' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.197 -0.939 . . . . 0.0 110.156 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.124 0.487 . . . . 0.0 110.305 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.752 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -79.13 -48.74 13.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -0.884 . . . . 0.0 110.12 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.498 ' CG ' HG13 ' A' ' 22' ' ' ILE . 9.5 pt-20 -47.51 -32.31 5.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.342 -0.849 . . . . 0.0 110.241 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.498 HG13 ' CG ' ' A' ' 21' ' ' GLU . 28.8 mt -80.25 -43.6 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.258 -0.901 . . . . 0.0 110.172 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.615 ' O ' HD11 ' A' ' 43' ' ' ILE . 5.5 mmtm -57.64 -30.46 65.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.256 -0.902 . . . . 0.0 110.193 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.879 HG22 HD21 ' A' ' 80' ' ' LEU . 44.2 t -77.94 -46.92 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.242 -0.911 . . . . 0.0 110.119 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.85 -39.7 26.68 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.336 -0.852 . . . . 0.0 110.102 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -76.29 -37.96 56.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.398 -0.814 . . . . 0.0 110.121 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 1.024 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -65.49 -13.26 58.44 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.322 -0.861 . . . . 0.0 109.964 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.584 ' HA ' ' CB ' ' A' ' 76' ' ' LYS . 8.5 p . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.284 -0.885 . . . . 0.0 110.188 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 1.024 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.189 0.519 . . . . 0.0 110.212 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.1 ttt -71.95 -60.54 2.18 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.29 -0.882 . . . . 0.0 110.18 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.407 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 82.7 p -53.84 -25.27 18.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.254 -0.904 . . . . 0.0 110.064 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -75.54 -53.17 9.05 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 110.114 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.865 HG21 HD11 ' A' ' 80' ' ' LEU . 59.3 mt -54.71 -35.3 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.297 -0.877 . . . . 0.0 110.134 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.659 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -71.75 -49.98 34.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.221 -0.924 . . . . 0.0 109.548 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.424 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 2.9 m-20 -53.29 -21.13 5.03 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.059 -1.025 . . . . 0.0 108.827 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.792 ' HB3' HD11 ' A' ' 56' ' ' ILE . 14.8 mt -79.25 -38.21 36.12 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.621 -0.674 . . . . 0.0 109.852 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.516 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 72.7 p -51.91 -43.76 63.53 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.103 -0.998 . . . . 0.0 109.156 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.43 ' CE2' ' O ' ' A' ' 87' ' ' THR . 87.5 m-85 -44.67 -42.99 7.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.285 -0.884 . . . . 0.0 109.578 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.543 ' O ' ' C ' ' A' ' 50' ' ' VAL . 14.7 m-20 -72.96 90.65 1.49 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.469 -0.77 . . . . 0.0 110.348 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.543 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.2 -59.04 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.25 178.295 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.535 ' H ' HG23 ' A' ' 50' ' ' VAL . 2.6 t -62.98 -64.17 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.09 -1.006 . . . . 0.0 110.1 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.79 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.81 -47.48 1.02 Allowed 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 121.171 0.51 . . . . 0.0 110.846 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.552 ' CZ ' ' OE1' ' A' ' 95' ' ' GLN . 9.7 t80 -56.36 -54.28 47.4 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.292 -0.88 . . . . 0.0 110.289 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.06 -27.59 54.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.219 -0.926 . . . . 0.0 110.196 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -82.92 -25.31 32.54 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.301 -0.874 . . . . 0.0 110.208 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.792 HD11 ' HB3' ' A' ' 46' ' ' LEU . 8.7 mt -79.21 -69.96 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.361 -0.837 . . . . 0.0 109.945 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.535 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 52.0 mmm -45.85 -37.69 6.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.155 -0.966 . . . . 0.0 109.745 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.3 t -55.19 -61.44 2.33 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.347 -0.845 . . . . 0.0 109.893 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.413 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -59.21 -21.45 59.52 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.153 -0.967 . . . . 0.0 109.859 179.689 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.677 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -76.24 -30.77 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.375 -0.828 . . . . 0.0 109.768 179.781 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 57' ' ' MET . 30.2 m95 -77.51 -51.0 11.45 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.891 . . . . 0.0 110.022 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.98 -51.77 49.41 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.241 -0.912 . . . . 0.0 109.969 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -69.01 -24.25 64.19 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.265 -0.897 . . . . 0.0 110.094 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 1.04 HD22 HD11 ' A' ' 106' ' ' LEU . 4.5 mt -71.07 -25.54 62.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.425 -0.797 . . . . 0.0 110.314 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.447 ' OD1' ' O ' ' A' ' 65' ' ' ASN . 18.1 t-20 . . . . . 0 N--CA 1.487 1.403 0 O-C-N 121.307 -0.871 . . . . 0.0 109.89 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.461 ' CE3' ' HB2' ' A' ' 75' ' ' TYR . 51.7 p-90 . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.16 0.505 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' A' ' 71' ' ' TRP . 42.7 mtt-85 -43.18 -41.92 3.96 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.315 -0.866 . . . . 0.0 110.404 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.1 m-70 -68.0 -43.84 77.97 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.107 -0.996 . . . . 0.0 110.248 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.685 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 70.5 t -56.08 -51.49 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.253 -0.904 . . . . 0.0 110.297 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.497 ' HB2' HG23 ' A' ' 123' ' ' VAL . 6.1 t80 -49.78 -64.56 0.77 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.141 -0.974 . . . . 0.0 109.975 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.584 ' CB ' ' HA ' ' A' ' 28' ' ' THR . 1.1 mmpt? -55.21 -21.7 14.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.327 -0.858 . . . . 0.0 110.044 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.907 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -69.79 -37.97 76.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.182 -0.949 . . . . 0.0 110.186 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.715 ' HE1' HG22 ' A' ' 123' ' ' VAL . 2.8 mpp? -68.39 -41.67 80.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.361 -0.837 . . . . 0.0 110.195 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.6 m -58.41 -45.99 87.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -0.889 . . . . 0.0 110.399 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.879 HD21 HG22 ' A' ' 24' ' ' VAL . 18.2 tp -58.45 -60.27 4.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.268 -0.895 . . . . 0.0 109.926 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.442 ' O ' HG13 ' A' ' 85' ' ' ILE . 28.1 ttm -53.78 -21.97 8.45 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.204 -0.935 . . . . 0.0 110.101 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.447 ' N ' HD11 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -79.89 -37.89 33.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.236 -0.915 . . . . 0.0 110.716 -179.751 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.722 ' O ' HG22 ' A' ' 87' ' ' THR . 32.3 t80 -81.0 -22.66 39.25 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.238 -0.914 . . . . 0.0 110.784 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.728 ' HB2' HG11 ' A' ' 92' ' ' VAL . 48.2 mt -85.17 -21.44 29.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.206 -0.934 . . . . 0.0 110.075 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.998 HG21 HD11 ' A' ' 134' ' ' LEU . 33.2 mt -76.64 -13.98 14.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.316 -0.865 . . . . 0.0 109.553 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -105.39 -48.02 3.8 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.382 -0.824 . . . . 0.0 110.044 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.722 HG22 ' O ' ' A' ' 83' ' ' TYR . 7.6 t -114.48 -2.72 13.12 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.272 -0.892 . . . . 0.0 110.168 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.614 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -89.88 34.88 3.92 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.548 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 2.5 t 74.28 150.14 0.11 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.447 -1.031 . . . . 0.0 110.157 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -65.18 -7.93 14.92 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.354 -0.841 . . . . 0.0 110.598 -179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -72.1 -38.47 69.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.111 -0.993 . . . . 0.0 109.732 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.728 HG11 ' HB2' ' A' ' 84' ' ' LEU . 84.0 t -60.08 -28.92 42.52 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.372 -0.83 . . . . 0.0 109.937 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.517 ' CB ' HG23 ' A' ' 85' ' ' ILE . 10.3 p -83.57 -38.92 21.03 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.283 -0.886 . . . . 0.0 109.982 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -58.03 -57.89 10.83 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.228 -0.92 . . . . 0.0 109.694 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.552 ' OE1' ' CZ ' ' A' ' 53' ' ' PHE . 34.8 tt0 -52.79 -35.7 57.09 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.454 -0.778 . . . . 0.0 109.448 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.416 ' SG ' HD11 ' A' ' 85' ' ' ILE . 1.7 t -55.41 -44.23 76.01 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 109.563 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -66.0 -46.81 76.65 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.497 -0.752 . . . . 0.0 109.747 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -65.01 -16.12 63.08 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.408 -0.807 . . . . 0.0 109.797 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.5 32.81 4.95 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.366 -0.834 . . . . 0.0 109.844 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.1 mtp -61.63 -28.26 69.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.298 -0.876 . . . . 0.0 110.224 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.476 ' O ' ' HB ' ' A' ' 105' ' ' THR . 15.6 m-85 -66.84 -24.97 66.21 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.236 -0.915 . . . . 0.0 109.934 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.951 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.59 -40.88 48.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.885 . . . . 0.0 110.008 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.538 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.9 t -75.06 -27.04 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.351 -0.843 . . . . 0.0 109.903 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.704 HE21 HG11 ' A' ' 131' ' ' VAL . 95.7 mt-30 -85.7 -28.24 24.79 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.411 -0.806 . . . . 0.0 109.985 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.4 t -53.44 -24.79 13.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.903 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 1.04 HD11 HD22 ' A' ' 64' ' ' LEU . 42.0 mt -70.53 -38.48 74.25 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.392 -0.818 . . . . 0.0 109.955 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.578 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 14.4 ttpt . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.245 -0.909 . . . . 0.0 109.888 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.555 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.1 p . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 121.335 0.588 . . . . 0.0 110.353 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.555 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.2 m-80 -40.91 -46.94 2.89 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.482 -0.761 . . . . 0.0 110.271 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.715 HG22 ' HE1' ' A' ' 78' ' ' MET . 0.9 OUTLIER -66.33 -42.92 91.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.319 -0.863 . . . . 0.0 109.867 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.578 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -56.87 -67.85 0.27 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.188 -0.945 . . . . 0.0 111.063 -179.554 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.18 -35.95 76.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.284 -0.885 . . . . 0.0 111.331 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 0.0 OUTLIER -57.56 -54.14 50.2 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.111 -0.993 . . . . 0.0 110.446 -179.561 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.538 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -57.25 -40.8 78.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.38 -0.825 . . . . 0.0 110.068 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt -62.5 -33.72 75.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.183 -0.948 . . . . 0.0 110.241 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.71 -40.27 96.63 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.287 -0.883 . . . . 0.0 110.586 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.903 HD21 ' CD1' ' A' ' 85' ' ' ILE . 0.6 OUTLIER -62.5 -53.05 60.44 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.248 -0.907 . . . . 0.0 110.569 -179.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.704 HG11 HE21 ' A' ' 104' ' ' GLN . 25.3 t -65.84 -25.68 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.408 -0.807 . . . . 0.0 110.413 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.92 -55.55 16.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.25 -0.906 . . . . 0.0 110.509 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.85 -56.94 15.17 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.137 -0.977 . . . . 0.0 110.307 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.998 HD11 HG21 ' A' ' 85' ' ' ILE . 3.0 mp . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.23 -0.919 . . . . 0.0 110.136 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 1.002 ' HB2' HD12 ' A' ' 22' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.205 0.526 . . . . 0.0 110.23 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.987 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -64.89 -56.8 11.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 110.216 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' A' ' 20' ' ' ALA . 18.8 pt-20 -42.96 -28.52 0.26 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.255 -0.903 . . . . 0.0 110.039 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 1.002 HD12 ' HB2' ' A' ' 19' ' ' GLU . 40.8 mt -74.19 -57.65 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.314 -0.866 . . . . 0.0 110.037 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.491 ' CB ' HG12 ' A' ' 43' ' ' ILE . 1.8 mmpt? -48.09 -51.05 26.14 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.351 -0.843 . . . . 0.0 110.214 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.943 HG13 ' CD2' ' A' ' 80' ' ' LEU . 20.0 t -56.28 -36.28 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.286 -0.884 . . . . 0.0 110.207 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.4 ttt85 -67.05 -38.14 85.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.2 -0.937 . . . . 0.0 110.177 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -81.18 -14.75 57.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.265 -0.897 . . . . 0.0 109.966 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.811 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -77.72 -20.29 53.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.867 . . . . 0.0 110.244 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.467 HG22 ' HB3' ' A' ' 76' ' ' LYS . 30.2 p . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.226 -0.921 . . . . 0.0 110.251 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.811 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.255 0.55 . . . . 0.0 110.263 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.573 ' CE ' HG22 ' A' ' 79' ' ' THR . 6.9 mmm -84.79 -45.79 12.01 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.186 -0.946 . . . . 0.0 110.207 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.408 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.2 OUTLIER -63.97 -29.34 70.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.355 -0.84 . . . . 0.0 110.277 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -72.77 -49.64 29.55 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.938 . . . . 0.0 110.102 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.799 HG21 HD11 ' A' ' 80' ' ' LEU . 44.7 mt -55.91 -33.87 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.273 -0.892 . . . . 0.0 110.022 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.64 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -71.63 -52.9 15.56 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.236 -0.915 . . . . 0.0 109.401 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.478 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 7.4 t70 -51.82 -22.38 3.63 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.059 -1.025 . . . . 0.0 108.742 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.987 HD22 ' HB2' ' A' ' 20' ' ' ALA . 8.1 mt -78.24 -40.03 38.47 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.611 -0.681 . . . . 0.0 110.017 179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.525 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 73.1 p -49.69 -42.0 44.64 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.11 -0.994 . . . . 0.0 109.159 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.561 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 83.7 m-85 -45.52 -46.27 13.85 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.234 -0.916 . . . . 0.0 109.367 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 50' ' ' VAL . 22.7 m-20 -71.14 89.65 0.85 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.529 -0.732 . . . . 0.0 110.358 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.73 -57.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.561 178.228 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.54 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -63.07 -65.9 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.04 -1.037 . . . . 0.0 110.069 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -38.16 -42.43 0.67 Allowed 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.305 0.574 . . . . 0.0 110.602 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.525 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 10.0 t80 -59.56 -53.65 55.67 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.376 -0.828 . . . . 0.0 109.952 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -30.36 62.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.28 -0.887 . . . . 0.0 109.745 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.68 -25.67 41.18 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.307 -0.871 . . . . 0.0 110.178 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.863 ' HA ' HG21 ' A' ' 24' ' ' VAL . 6.9 mt -77.59 -70.18 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.324 -0.86 . . . . 0.0 110.283 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.497 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 91.6 mmm -47.75 -36.31 11.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.21 -0.931 . . . . 0.0 109.91 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 t -55.21 -60.67 3.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.377 -0.827 . . . . 0.0 109.971 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.27 -25.6 65.83 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -0.953 . . . . 0.0 109.687 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.647 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -71.1 -29.59 37.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.379 -0.825 . . . . 0.0 109.506 179.641 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.477 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 13.4 m95 -78.21 -41.04 35.69 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.239 -0.913 . . . . 0.0 109.964 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.78 -53.03 53.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.329 -0.857 . . . . 0.0 109.964 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.488 ' HB3' ' HB3' ' A' ' 73' ' ' HIS . 4.0 mmt180 -70.06 -33.83 72.43 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.381 -0.824 . . . . 0.0 109.992 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.941 HD22 HD11 ' A' ' 106' ' ' LEU . 11.8 mt -65.11 -9.45 22.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.447 -0.783 . . . . 0.0 110.357 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--N 1.302 -1.473 0 O-C-N 121.307 -0.87 . . . . 0.0 110.156 -179.857 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.455 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 35.7 p-90 . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.209 0.528 . . . . 0.0 110.048 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -52.56 -39.59 61.66 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.392 -0.817 . . . . 0.0 110.287 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.488 ' HB3' ' HB3' ' A' ' 63' ' ' ARG . 5.0 m-70 -61.99 -36.81 82.6 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.207 -0.933 . . . . 0.0 110.111 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.813 HG12 HG22 ' A' ' 123' ' ' VAL . 24.5 t -59.06 -54.54 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.31 -0.869 . . . . 0.0 110.125 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.461 ' HA ' ' HE1' ' A' ' 78' ' ' MET . 22.7 t80 -49.91 -56.45 10.5 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.183 -0.948 . . . . 0.0 109.995 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.467 ' HB3' HG22 ' A' ' 28' ' ' THR . 0.0 OUTLIER -59.74 -25.81 65.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.352 -0.843 . . . . 0.0 110.036 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.793 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -73.12 -27.43 61.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.317 -0.864 . . . . 0.0 110.038 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.643 ' SD ' HD13 ' A' ' 106' ' ' LEU . 1.5 mpp? -74.76 -32.96 62.21 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.327 -0.858 . . . . 0.0 109.991 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.573 HG22 ' CE ' ' A' ' 40' ' ' MET . 35.9 m -74.69 -27.74 60.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.399 -0.813 . . . . 0.0 110.283 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.943 ' CD2' HG13 ' A' ' 24' ' ' VAL . 19.5 tp -76.09 -53.49 8.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.161 -0.962 . . . . 0.0 109.378 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.808 ' HE2' HD11 ' A' ' 64' ' ' LEU . 6.5 ttp -61.39 -20.62 63.24 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.158 -0.964 . . . . 0.0 109.724 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.576 ' CB ' HD13 ' A' ' 130' ' ' LEU . 13.4 tm-20 -88.36 -33.49 17.93 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.167 -0.958 . . . . 0.0 110.354 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.49 ' O ' HG22 ' A' ' 87' ' ' THR . 10.5 t80 -79.87 -21.92 43.48 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.269 -0.894 . . . . 0.0 110.467 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.581 HD13 HG21 ' A' ' 56' ' ' ILE . 68.5 mt -88.86 -34.74 16.89 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.261 -0.899 . . . . 0.0 110.021 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.813 HD12 HD11 ' A' ' 130' ' ' LEU . 37.5 mt -56.95 -22.95 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.061 -1.024 . . . . 0.0 109.972 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -95.24 -80.49 0.41 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.233 -0.917 . . . . 0.0 110.284 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.64 HG23 ' HB1' ' A' ' 44' ' ' ALA . 7.9 t -75.65 -24.44 56.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.254 -0.904 . . . . 0.0 110.319 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.561 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -49.34 -77.29 0.13 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.0 t 177.09 154.16 0.24 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.251 -1.146 . . . . 0.0 110.31 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.47 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 1.6 mt-10 -55.92 -17.19 5.91 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.902 . . . . 0.0 110.303 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -77.02 -38.02 53.81 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.181 -0.949 . . . . 0.0 110.11 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.486 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 73.1 t -59.67 -38.96 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.213 -0.929 . . . . 0.0 110.084 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.91 -40.24 72.28 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.881 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 90' ' ' GLU . 5.6 mt-30 -60.72 -39.77 89.81 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.229 -0.919 . . . . 0.0 109.994 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.441 ' HA ' ' OE1' ' A' ' 95' ' ' GLN . 3.5 tp60 -65.07 -39.59 93.46 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.321 -0.862 . . . . 0.0 109.259 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.814 ' HB3' HD13 ' A' ' 134' ' ' LEU . 2.8 m -56.2 -41.31 75.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.341 -0.849 . . . . 0.0 109.503 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 22.0 mtmt -67.56 -32.46 73.25 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.497 -0.752 . . . . 0.0 109.441 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -80.31 -14.32 58.47 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.411 -0.805 . . . . 0.0 109.68 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -129.86 33.4 4.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.452 -0.78 . . . . 0.0 110.08 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . 0.459 ' HE3' ' CZ ' ' A' ' 101' ' ' TYR . 8.4 ptt? -60.74 -28.94 69.07 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.247 -0.908 . . . . 0.0 110.252 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.459 ' CZ ' ' HE3' ' A' ' 100' ' ' MET . 41.5 m-85 -65.61 -26.4 67.81 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.337 -0.852 . . . . 0.0 110.198 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.969 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.65 -41.4 45.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 110.133 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.429 HG23 ' H ' ' A' ' 103' ' ' VAL . 2.5 t -73.2 -25.85 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.324 -0.86 . . . . 0.0 109.989 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -87.65 -24.82 23.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.287 -0.883 . . . . 0.0 110.452 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.969 HG22 ' O ' ' A' ' 102' ' ' ALA . 12.0 t -63.59 -12.61 34.57 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.186 -0.946 . . . . 0.0 110.368 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.941 HD11 HD22 ' A' ' 64' ' ' LEU . 17.4 mt -73.86 -40.05 63.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.189 -0.944 . . . . 0.0 110.219 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.161 -0.962 . . . . 0.0 110.025 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.561 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.9 p . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 121.332 0.587 . . . . 0.0 110.26 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.561 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 2.6 t30 -40.56 -27.68 0.05 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.595 -0.69 . . . . 0.0 110.257 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.813 HG22 HG12 ' A' ' 74' ' ' VAL . 2.0 t -76.74 -49.23 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.245 -0.909 . . . . 0.0 109.968 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -60.34 -36.8 78.81 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.116 -0.99 . . . . 0.0 110.802 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -77.93 -61.41 2.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.183 -0.948 . . . . 0.0 110.88 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -48.65 -44.52 37.62 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.151 -0.968 . . . . 0.0 110.268 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.504 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -65.38 -44.14 88.49 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.298 -0.876 . . . . 0.0 110.411 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -49.79 -39.13 37.12 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.186 -0.946 . . . . 0.0 110.505 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -71.31 -50.95 27.31 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.221 -0.924 . . . . 0.0 110.438 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.813 HD11 HD12 ' A' ' 85' ' ' ILE . 11.9 tp -49.48 -22.31 1.17 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.247 -0.908 . . . . 0.0 110.317 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 127' ' ' ALA . 42.8 t -92.19 -31.76 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 110.304 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.408 ' O ' ' C ' ' A' ' 133' ' ' LEU . . . -70.37 -63.13 1.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.318 -0.864 . . . . 0.0 110.302 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.408 ' C ' ' O ' ' A' ' 132' ' ' ALA . 13.2 tp -43.53 -27.42 0.29 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.228 -0.92 . . . . 0.0 110.351 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.814 HD13 ' HB3' ' A' ' 96' ' ' CYS . 20.5 mt . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.914 . . . . 0.0 110.335 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.451 ' O ' ' HB ' ' A' ' 22' ' ' ILE . 4.5 mt-10 . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.093 0.473 . . . . 0.0 110.344 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.851 ' HB2' HD13 ' A' ' 46' ' ' LEU . . . -57.19 -50.45 72.8 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.918 . . . . 0.0 110.095 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 1.2 pt-20 -48.52 -28.06 3.12 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.203 -0.936 . . . . 0.0 109.897 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.451 ' HB ' ' O ' ' A' ' 19' ' ' GLU . 49.3 mm -73.29 -41.47 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.295 -0.878 . . . . 0.0 109.904 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.473 ' CB ' HG12 ' A' ' 43' ' ' ILE . 11.6 mmtt -64.56 -42.75 95.47 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.253 -0.904 . . . . 0.0 109.907 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 1.036 HG22 HD21 ' A' ' 80' ' ' LEU . 14.8 t -64.81 -30.65 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.264 -0.897 . . . . 0.0 110.03 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -62.34 -42.69 99.59 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.201 -0.937 . . . . 0.0 110.04 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -83.44 -19.88 35.12 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.48 -0.763 . . . . 0.0 110.108 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.872 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -81.25 -14.16 57.74 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.307 -0.87 . . . . 0.0 110.25 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.492 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 3.8 p . . . . . 0 N--CA 1.491 1.623 0 O-C-N 121.24 -0.912 . . . . 0.0 110.292 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.872 HD21 ' HB2' ' A' ' 27' ' ' ALA . 1.9 tp . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.177 0.513 . . . . 0.0 110.369 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -44.45 77.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.266 -0.896 . . . . 0.0 110.497 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.411 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.1 OUTLIER -66.5 -28.25 68.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.171 -0.956 . . . . 0.0 110.589 -179.767 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.68 -47.73 44.97 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.203 -0.936 . . . . 0.0 110.257 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.648 HG23 HG12 ' A' ' 56' ' ' ILE . 62.6 mt -57.25 -36.09 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.177 -0.952 . . . . 0.0 110.029 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.725 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.33 -49.84 45.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.174 -0.954 . . . . 0.0 109.522 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -51.25 -22.27 2.61 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.029 -1.044 . . . . 0.0 108.831 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.851 HD13 ' HB2' ' A' ' 20' ' ' ALA . 12.4 mt -81.99 -37.99 25.79 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.623 -0.673 . . . . 0.0 110.245 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.573 HG21 HG21 ' A' ' 92' ' ' VAL . 71.8 p -50.51 -40.53 51.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.111 -0.993 . . . . 0.0 109.474 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 49' ' ' ASN . 66.9 m-85 -44.61 -46.75 10.23 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 119.624 -0.83 . . . . 0.0 109.122 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.473 ' O ' ' O ' ' A' ' 48' ' ' TYR . 0.8 OUTLIER -55.62 -158.76 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 CA-C-O 121.98 0.895 . . . . 0.0 110.498 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.428 ' CG2' ' N ' ' A' ' 51' ' ' VAL . 3.1 m -125.5 -34.67 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -178.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.541 HG12 ' N ' ' A' ' 52' ' ' ALA . 8.5 t -82.88 -70.64 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 CA-C-O 122.07 0.938 . . . . 0.0 109.618 178.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.665 ' HB1' ' HB2' ' A' ' 20' ' ' ALA . . . -40.37 -41.58 1.4 Allowed 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.247 -178.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.543 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 12.6 t80 -56.2 -52.6 63.84 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.471 -0.768 . . . . 0.0 109.861 179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 58' ' ' SER . 40.9 t -60.49 -26.86 67.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.316 -0.865 . . . . 0.0 109.643 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 1.7 mm-40 -81.45 -21.56 38.74 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.47 -0.769 . . . . 0.0 109.782 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.648 HG12 HG23 ' A' ' 43' ' ' ILE . 7.7 mt -81.78 -70.12 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.328 -0.857 . . . . 0.0 109.851 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.418 ' HA ' ' HB ' ' A' ' 60' ' ' ILE . 79.8 mmm -49.73 -36.68 26.42 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.31 -0.869 . . . . 0.0 109.73 179.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 54' ' ' SER . 2.2 m -55.83 -60.41 3.5 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.316 -0.865 . . . . 0.0 109.696 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.406 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.5 OUTLIER -59.38 -23.84 62.93 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.253 -0.904 . . . . 0.0 109.674 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.547 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -71.64 -33.14 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.427 -0.796 . . . . 0.0 109.569 179.776 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.422 ' CH2' ' CE ' ' A' ' 81' ' ' MET . 28.2 m95 -77.91 -31.35 51.12 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.212 -0.93 . . . . 0.0 109.998 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.93 -57.51 7.69 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.271 -0.893 . . . . 0.0 110.108 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.403 ' NH1' ' CE1' ' A' ' 73' ' ' HIS . 13.7 mmt180 -66.42 -9.89 38.43 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.191 -0.943 . . . . 0.0 109.906 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.984 HD22 HD11 ' A' ' 106' ' ' LEU . 6.2 mt -84.83 -17.65 37.4 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.343 -0.848 . . . . 0.0 110.325 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.0 m-20 . . . . . 0 C--N 1.302 -1.458 0 O-C-N 121.238 -0.914 . . . . 0.0 109.904 -179.738 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.415 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 70.0 p-90 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.261 0.553 . . . . 0.0 110.142 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 13.2 mtp180 -52.63 -41.89 64.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.22 -0.925 . . . . 0.0 110.234 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.403 ' CE1' ' NH1' ' A' ' 63' ' ' ARG . 10.0 m170 -60.62 -41.59 95.17 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.192 -0.943 . . . . 0.0 110.085 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.629 HG11 ' CG1' ' A' ' 123' ' ' VAL . 24.7 t -56.05 -50.8 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.289 -0.882 . . . . 0.0 110.022 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.558 ' CE1' ' O ' ' A' ' 122' ' ' ASN . 7.4 t80 -49.47 -56.7 8.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.207 -0.933 . . . . 0.0 110.226 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -59.19 -26.93 65.24 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.196 -0.94 . . . . 0.0 109.951 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.776 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -70.15 -28.68 65.54 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 110.182 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.694 ' SD ' HD21 ' A' ' 64' ' ' LEU . 1.6 mpp? -76.43 -32.08 58.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.405 -0.809 . . . . 0.0 110.229 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 9.9 m -66.9 -40.18 87.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.082 -1.011 . . . . 0.0 110.122 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 1.036 HD21 HG22 ' A' ' 24' ' ' VAL . 16.2 tp -64.94 -54.14 35.42 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.333 -0.854 . . . . 0.0 109.783 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.529 ' HE2' HG22 ' A' ' 103' ' ' VAL . 0.2 OUTLIER -59.19 -25.27 63.81 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.868 . . . . 0.0 109.887 179.561 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.579 ' HB2' HD12 ' A' ' 130' ' ' LEU . 0.9 OUTLIER -78.46 -34.13 47.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.252 -0.905 . . . . 0.0 110.385 179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.578 ' O ' HG22 ' A' ' 87' ' ' THR . 26.0 t80 -85.6 -16.61 38.72 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.262 -0.899 . . . . 0.0 110.714 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.725 HD23 ' HB2' ' A' ' 44' ' ' ALA . 85.1 mt -92.54 -38.98 11.62 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.166 -0.959 . . . . 0.0 110.232 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.856 HD13 HD11 ' A' ' 134' ' ' LEU . 52.0 mt -57.1 -17.19 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.115 -0.991 . . . . 0.0 109.807 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.58 -80.54 0.47 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.294 -0.879 . . . . 0.0 110.191 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.578 HG22 ' O ' ' A' ' 83' ' ' TYR . 15.0 t -77.72 -18.77 56.22 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.201 -0.937 . . . . 0.0 110.142 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.479 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -55.99 -74.35 0.33 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.212 -1.555 . . . . 0.0 109.212 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 174.47 152.43 0.11 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -1.12 . . . . 0.0 110.337 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -51.98 -24.43 6.53 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 110.109 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.517 ' O ' ' HG2' ' A' ' 94' ' ' GLN . 40.4 mtt180 -70.26 -44.23 68.88 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.304 -0.873 . . . . 0.0 109.722 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 47' ' ' THR . 39.7 t -59.04 -22.16 21.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 120.874 -1.141 . . . . 0.0 108.995 179.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.703 ' HB2' HG23 ' A' ' 85' ' ' ILE . 1.9 t -95.18 -19.2 20.26 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.585 -0.697 . . . . 0.0 110.49 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.598 ' CG ' ' N ' ' A' ' 95' ' ' GLN . 7.2 pt20 -79.53 -48.2 14.26 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.93 -1.106 . . . . 0.0 109.104 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.598 ' N ' ' CG ' ' A' ' 94' ' ' GLN . 7.9 tt0 -63.12 -36.45 83.65 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 36.4 t -59.77 -36.27 76.32 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.344 -0.848 . . . . 0.0 109.403 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.18 -35.53 66.41 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.417 -0.802 . . . . 0.0 109.466 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -74.46 -18.29 60.65 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.481 -0.762 . . . . 0.0 109.652 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -121.97 36.8 4.53 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.511 -0.743 . . . . 0.0 109.988 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . 0.845 ' SD ' HG13 ' A' ' 131' ' ' VAL . 2.0 tpp -59.57 -30.19 68.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.196 -0.94 . . . . 0.0 110.032 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.462 ' O ' ' HB ' ' A' ' 105' ' ' THR . 17.5 m-85 -62.03 -30.04 70.69 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.287 -0.883 . . . . 0.0 109.878 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.957 ' O ' HG22 ' A' ' 105' ' ' THR . . . -70.34 -40.18 74.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.341 -0.849 . . . . 0.0 110.13 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.529 HG22 ' HE2' ' A' ' 81' ' ' MET . 4.6 t -74.86 -27.84 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.354 -0.841 . . . . 0.0 110.332 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.513 ' O ' ' CG ' ' A' ' 107' ' ' LYS . 2.0 mm100 -88.63 -19.51 26.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.314 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.957 HG22 ' O ' ' A' ' 102' ' ' ALA . 11.0 t -67.14 -14.73 63.18 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.17 -0.956 . . . . 0.0 109.985 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.984 HD11 HD22 ' A' ' 64' ' ' LEU . 56.6 mt -77.01 -37.82 54.29 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.348 -0.845 . . . . 0.0 110.169 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.542 ' HA ' ' CB ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.276 -0.89 . . . . 0.0 110.085 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.609 HG22 ' HG3' ' A' ' 125' ' ' GLU . 3.4 p . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 121.214 0.53 . . . . 0.0 110.213 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.558 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 20.7 m-20 -37.16 -28.77 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.8 -0.562 . . . . 0.0 110.788 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.629 ' CG1' HG11 ' A' ' 74' ' ' VAL . 20.4 t -86.25 -63.06 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.247 -0.908 . . . . 0.0 110.303 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.542 ' CB ' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -41.96 -34.01 0.63 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.154 -0.966 . . . . 0.0 110.935 -179.578 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.609 ' HG3' HG22 ' A' ' 121' ' ' VAL . 3.2 mt-10 -82.18 -54.57 5.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.084 -1.01 . . . . 0.0 111.311 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.535 ' HB3' ' HE2' ' A' ' 78' ' ' MET . 0.0 OUTLIER -50.72 -50.14 56.07 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.969 -1.082 . . . . 0.0 110.338 -179.395 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.463 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -61.22 -42.87 99.36 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.38 -0.825 . . . . 0.0 110.408 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -55.51 -56.52 19.28 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.248 -0.907 . . . . 0.0 110.416 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -44.2 65.4 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.265 -0.897 . . . . 0.0 110.494 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.579 HD12 ' HB2' ' A' ' 82' ' ' GLU . 1.1 tt -56.04 -40.89 74.15 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.115 -0.991 . . . . 0.0 110.134 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.845 HG13 ' SD ' ' A' ' 100' ' ' MET . 38.6 t -68.13 -24.8 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.369 -0.832 . . . . 0.0 110.031 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -75.81 -51.66 12.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.351 -0.843 . . . . 0.0 110.385 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -35.13 21.52 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 0.0 110.667 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.856 HD11 HD13 ' A' ' 85' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.425 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.062 0.458 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.68 ' HB2' HD13 ' A' ' 46' ' ' LEU . . . -65.93 -46.14 79.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.178 -0.951 . . . . 0.0 110.067 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.488 ' HG3' HG13 ' A' ' 22' ' ' ILE . 12.8 pt-20 -51.97 -28.81 18.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.158 -0.964 . . . . 0.0 110.014 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.488 HG13 ' HG3' ' A' ' 21' ' ' GLU . 64.4 mt -79.34 -47.32 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.292 -0.88 . . . . 0.0 109.992 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.573 ' O ' HD11 ' A' ' 43' ' ' ILE . 1.8 ttmt -57.91 -30.13 65.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.313 -0.867 . . . . 0.0 110.112 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.792 HG22 HD21 ' A' ' 80' ' ' LEU . 42.4 t -78.96 -41.71 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 109.949 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.506 ' HG2' ' NH1' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -55.59 -42.75 75.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.293 -0.88 . . . . 0.0 109.971 179.88 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -76.21 -30.48 58.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.332 -0.855 . . . . 0.0 110.048 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.768 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -66.05 -16.03 63.57 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.26 -0.9 . . . . 0.0 110.014 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.555 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 80.7 p . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.242 -0.911 . . . . 0.0 110.137 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.768 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.24 0.543 . . . . 0.0 110.224 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -58.01 4.0 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.223 -0.923 . . . . 0.0 110.15 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -44.64 -35.19 2.49 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.321 -0.862 . . . . 0.0 110.168 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.508 ' HB3' ' HD3' ' A' ' 23' ' ' LYS . 29.5 mt-10 -68.4 -56.75 7.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 110.11 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.682 HG21 HD11 ' A' ' 80' ' ' LEU . 5.8 mt -48.64 -35.01 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.0 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.647 ' HA ' HD22 ' A' ' 84' ' ' LEU . . . -69.75 -51.7 31.79 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.204 -0.935 . . . . 0.0 109.776 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.424 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 7.0 m-20 -51.59 -21.74 2.79 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.045 -1.034 . . . . 0.0 109.114 179.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.68 HD13 ' HB2' ' A' ' 20' ' ' ALA . 21.4 mt -81.35 -38.48 26.58 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.557 -0.715 . . . . 0.0 110.168 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.559 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 77.3 p -51.07 -42.39 60.54 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.201 -0.937 . . . . 0.0 109.453 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.514 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 74.9 m-85 -43.82 -45.74 7.5 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.732 -0.787 . . . . 0.0 109.191 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.456 ' O ' ' O ' ' A' ' 48' ' ' TYR . 2.1 t-20 -56.61 -159.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.816 0.817 . . . . 0.0 110.32 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.1 t -124.76 -32.9 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-O 121.52 0.676 . . . . 0.0 109.4 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.561 HG12 ' N ' ' A' ' 52' ' ' ALA . 13.1 t -84.6 -72.72 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 CA-C-O 122.059 0.933 . . . . 0.0 109.816 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.561 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -39.14 -41.02 0.78 Allowed 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.482 -178.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.559 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 27.3 t80 -55.56 -53.78 52.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.467 -0.771 . . . . 0.0 109.839 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.72 -27.22 67.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.284 -0.885 . . . . 0.0 109.985 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -82.98 -19.39 37.17 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.286 -0.884 . . . . 0.0 110.018 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.682 ' HA ' HG21 ' A' ' 24' ' ' VAL . 11.2 mt -82.09 -68.8 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.694 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.519 ' SD ' HG13 ' A' ' 92' ' ' VAL . 94.3 mmm -47.27 -34.82 7.03 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.297 -0.877 . . . . 0.0 109.484 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.09 -62.53 1.75 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.432 -0.792 . . . . 0.0 109.85 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.48 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -57.4 -20.18 28.2 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.268 -0.895 . . . . 0.0 109.763 179.532 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.653 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -77.99 -32.99 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.815 . . . . 0.0 109.987 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.475 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 20.4 m95 -76.43 -43.66 39.18 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.905 . . . . 0.0 110.267 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.47 -54.51 46.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.338 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.506 ' NH1' ' HG2' ' A' ' 25' ' ' ARG . 8.4 mtt-85 -69.04 -14.15 62.86 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.23 -0.919 . . . . 0.0 110.184 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.885 HD22 HD11 ' A' ' 106' ' ' LEU . 4.2 mt -77.87 -24.82 48.41 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.215 -0.928 . . . . 0.0 110.189 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 C--N 1.302 -1.488 0 O-C-N 121.417 -0.802 . . . . 0.0 109.806 -179.776 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.479 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 25.1 p-90 . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 121.225 0.536 . . . . 0.0 110.043 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.3 -47.49 36.47 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.092 -1.005 . . . . 0.0 109.983 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -40.15 61.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.235 -0.916 . . . . 0.0 109.984 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.754 HG11 HD22 ' A' ' 106' ' ' LEU . 49.5 t -63.09 -57.6 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.421 -0.799 . . . . 0.0 110.25 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.569 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 11.2 t80 -44.76 -55.7 5.1 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.456 -0.777 . . . . 0.0 110.161 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.555 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 12.3 mmtt -61.71 -31.43 71.58 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.239 -0.913 . . . . 0.0 110.069 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.828 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -66.98 -24.4 66.04 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.243 -0.91 . . . . 0.0 109.754 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.661 ' HG2' HD21 ' A' ' 64' ' ' LEU . 0.3 OUTLIER -79.44 -31.4 42.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.359 -0.838 . . . . 0.0 110.144 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 93.5 m -68.58 -35.33 77.23 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.253 -0.904 . . . . 0.0 110.328 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.792 HD21 HG22 ' A' ' 24' ' ' VAL . 30.9 tp -73.25 -36.66 66.42 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.206 -0.934 . . . . 0.0 109.764 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.647 ' O ' HD12 ' A' ' 85' ' ' ILE . 3.6 ttp -71.0 -34.75 71.67 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.167 -0.958 . . . . 0.0 109.823 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.548 ' HB2' HD13 ' A' ' 130' ' ' LEU . 16.4 tt0 -75.72 -36.14 60.05 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.319 -0.863 . . . . 0.0 110.81 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.564 ' O ' HG22 ' A' ' 87' ' ' THR . 54.0 t80 -72.18 -42.77 65.49 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.168 -0.957 . . . . 0.0 110.455 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.647 HD22 ' HA ' ' A' ' 44' ' ' ALA . 53.8 mt -71.42 -29.1 64.5 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.154 -0.966 . . . . 0.0 110.304 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.714 HG13 HG12 ' A' ' 92' ' ' VAL . 22.6 mt -64.0 -23.17 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.115 -0.991 . . . . 0.0 109.883 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -98.98 -69.58 0.76 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.946 . . . . 0.0 110.167 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.564 HG22 ' O ' ' A' ' 83' ' ' TYR . 14.3 t -84.39 -27.18 27.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.253 -0.904 . . . . 0.0 110.238 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.514 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -48.51 -73.42 0.34 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 7.2 t 174.35 162.91 0.2 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -1.143 . . . . 0.0 110.199 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -62.27 -12.69 22.0 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.274 -0.891 . . . . 0.0 110.199 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.484 ' NH2' ' HG3' ' A' ' 94' ' ' GLN . 5.9 mmp_? -79.01 -43.05 25.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.259 -0.901 . . . . 0.0 110.265 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.714 HG12 HG13 ' A' ' 85' ' ' ILE . 82.4 t -60.13 -26.0 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.189 -0.944 . . . . 0.0 109.955 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.82 -31.42 23.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.31 -0.869 . . . . 0.0 109.732 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.484 ' HG3' ' NH2' ' A' ' 91' ' ' ARG . 13.3 mm100 -67.95 -48.69 65.18 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.302 -0.874 . . . . 0.0 109.807 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -59.42 -36.88 76.7 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.34 -0.85 . . . . 0.0 109.585 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.712 ' HB3' HD13 ' A' ' 134' ' ' LEU . 44.5 m -56.96 -42.18 79.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.392 -0.817 . . . . 0.0 109.524 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.0 tttp -68.48 -29.07 67.6 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.461 -0.774 . . . . 0.0 109.679 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -83.64 -14.59 51.55 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.387 -0.821 . . . . 0.0 110.077 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -126.21 39.78 3.87 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.364 -0.835 . . . . 0.0 110.271 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 6.1 ttm -65.5 -30.07 70.8 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.186 -0.947 . . . . 0.0 110.206 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.449 ' O ' ' HB ' ' A' ' 105' ' ' THR . 59.7 m-85 -64.39 -12.59 44.29 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.288 -0.883 . . . . 0.0 110.018 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.835 ' O ' HG22 ' A' ' 105' ' ' THR . . . -90.61 -40.67 11.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 110.224 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.443 HG12 HG23 ' A' ' 131' ' ' VAL . 2.4 t -75.94 -21.01 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.322 -0.862 . . . . 0.0 109.911 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -91.53 -26.43 18.77 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.373 -0.83 . . . . 0.0 110.316 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.835 HG22 ' O ' ' A' ' 102' ' ' ALA . 9.2 t -65.4 -16.04 63.21 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.91 . . . . 0.0 110.177 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.885 HD11 HD22 ' A' ' 64' ' ' LEU . 15.4 mt -70.58 -39.85 73.62 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.283 -0.886 . . . . 0.0 110.336 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.331 -0.855 . . . . 0.0 110.195 179.898 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.0 p . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 121.488 0.661 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.9 OUTLIER -50.88 -49.31 59.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.452 -0.78 . . . . 0.0 110.498 -179.838 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.612 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 9.7 p -77.3 -16.0 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.164 -0.96 . . . . 0.0 110.398 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -66.97 0.78 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.197 -0.939 . . . . 0.0 110.599 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.475 ' CG ' ' N ' ' A' ' 126' ' ' LYS . 13.8 pt-20 -60.02 -43.62 95.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.398 -0.814 . . . . 0.0 110.679 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.569 ' HG3' ' CE1' ' A' ' 75' ' ' TYR . 7.4 tmtm? -54.55 -51.64 64.6 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.125 -0.985 . . . . 0.0 110.161 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.564 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -53.99 -41.37 67.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.145 -0.972 . . . . 0.0 110.15 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.423 ' HB3' ' HE2' ' A' ' 128' ' ' LYS . 30.0 ttpt -58.21 -39.93 80.28 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.226 -0.921 . . . . 0.0 110.041 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.459 ' HB2' ' O ' ' A' ' 126' ' ' LYS . 7.9 mt-30 -57.3 -48.61 78.5 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.305 -0.872 . . . . 0.0 110.174 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.58 ' O ' HD12 ' A' ' 134' ' ' LEU . 9.2 tp -57.59 -28.78 63.92 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.172 -0.955 . . . . 0.0 109.677 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.443 HG23 HG12 ' A' ' 103' ' ' VAL . 43.1 t -78.29 -27.9 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.343 -0.848 . . . . 0.0 109.513 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.61 -53.35 12.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.461 -0.774 . . . . 0.0 110.252 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.2 mp -56.13 -32.71 64.48 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.231 -0.918 . . . . 0.0 110.176 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.712 HD13 ' HB3' ' A' ' 96' ' ' CYS . 31.4 mt . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 0.0 110.192 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.534 ' HG2' HD12 ' A' ' 22' ' ' ILE . 38.0 mt-10 . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.216 0.531 . . . . 0.0 110.122 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.896 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -66.68 -56.54 10.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.265 -0.897 . . . . 0.0 110.221 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.412 ' C ' ' O ' ' A' ' 20' ' ' ALA . 15.1 pt-20 -42.97 -29.55 0.34 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.306 -0.871 . . . . 0.0 110.197 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.534 HD12 ' HG2' ' A' ' 19' ' ' GLU . 36.4 mt -79.78 -48.73 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.255 -0.903 . . . . 0.0 110.121 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.55 ' O ' HD11 ' A' ' 43' ' ' ILE . 2.6 mmtm -50.46 -35.75 30.34 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 0.0 110.037 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.654 HG13 ' CD2' ' A' ' 80' ' ' LEU . 98.3 t -72.46 -48.15 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.333 -0.855 . . . . 0.0 110.106 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.71 -51.2 40.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.176 -0.952 . . . . 0.0 110.009 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -65.69 -29.17 69.68 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.936 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.789 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -74.28 -19.51 60.47 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.275 -0.891 . . . . 0.0 110.022 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 76' ' ' LYS . 34.5 p . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.328 -0.858 . . . . 0.0 110.262 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.789 HD21 ' HB2' ' A' ' 27' ' ' ALA . 1.3 tp . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.293 0.568 . . . . 0.0 110.234 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.5 mtt -60.03 -51.9 67.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.157 -0.964 . . . . 0.0 110.195 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 98.0 p -52.78 -26.32 13.97 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.201 -0.937 . . . . 0.0 110.141 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 8.3 mm-40 -78.08 -54.99 5.65 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.251 -0.906 . . . . 0.0 110.2 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.766 HG21 HD11 ' A' ' 80' ' ' LEU . 54.6 mt -51.83 -38.11 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.187 -0.945 . . . . 0.0 109.998 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.492 ' CA ' HD22 ' A' ' 84' ' ' LEU . . . -68.61 -53.16 24.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.09 -1.006 . . . . 0.0 109.269 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.5 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 4.9 t70 -51.25 -22.06 2.49 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.13 -0.981 . . . . 0.0 109.147 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.896 HD22 ' HB2' ' A' ' 20' ' ' ALA . 8.5 mt -80.15 -39.72 28.81 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.5 -0.75 . . . . 0.0 110.053 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.782 HG21 ' HB3' ' A' ' 84' ' ' LEU . 81.7 p -48.54 -38.98 21.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.094 -1.004 . . . . 0.0 109.26 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.585 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 63.3 m-85 -45.28 -49.62 12.45 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.401 -0.92 . . . . 0.0 109.442 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.544 ' O ' ' C ' ' A' ' 50' ' ' VAL . 49.2 m-20 -70.49 92.29 0.82 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.672 -0.642 . . . . 0.0 110.8 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.544 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -12.16 -57.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.21 178.095 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.551 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.6 t -62.54 -64.85 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.07 -1.019 . . . . 0.0 109.888 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.632 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -38.03 -40.98 0.53 Allowed 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.302 0.572 . . . . 0.0 110.568 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.61 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 29.1 t80 -64.81 -57.48 8.77 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.453 -0.779 . . . . 0.0 110.265 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -26.82 9.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.213 -0.929 . . . . 0.0 110.016 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -84.17 -31.72 24.99 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.238 -0.914 . . . . 0.0 109.981 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.824 HD11 ' HB3' ' A' ' 46' ' ' LEU . 17.0 mt -74.66 -68.48 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.396 -0.815 . . . . 0.0 110.117 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.61 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 14.1 mmm -43.8 -38.83 3.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.267 -0.896 . . . . 0.0 109.729 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.83 -59.87 3.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.394 -0.816 . . . . 0.0 109.951 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 16.4 mmt -60.11 -21.94 62.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.263 -0.898 . . . . 0.0 109.896 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.666 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -76.92 -28.28 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.425 -0.797 . . . . 0.0 109.878 179.898 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 14.4 m95 -81.99 -29.54 32.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.276 -0.89 . . . . 0.0 110.373 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -58.54 3.4 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.378 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -64.57 -24.02 67.46 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.185 -0.947 . . . . 0.0 110.139 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.99 HD22 HD11 ' A' ' 106' ' ' LEU . 5.6 mt -66.14 -16.28 63.83 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.0 110.392 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.9 m-20 . . . . . 0 C--N 1.302 -1.461 0 O-C-N 121.293 -0.879 . . . . 0.0 110.058 -179.528 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.435 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 19.6 p-90 . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.168 0.509 . . . . 0.0 110.381 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 39.2 mtt85 -48.93 -46.21 42.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.107 -0.996 . . . . 0.0 110.092 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 -58.73 -48.88 79.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.227 -0.92 . . . . 0.0 110.107 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.744 HG12 HG13 ' A' ' 123' ' ' VAL . 16.9 t -46.62 -44.72 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.269 -0.895 . . . . 0.0 110.181 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.51 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 4.0 t80 -55.72 -54.87 39.02 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.251 -0.906 . . . . 0.0 110.283 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.556 ' O ' HG22 ' A' ' 28' ' ' THR . 0.2 OUTLIER -71.17 -9.11 57.52 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.898 -1.126 . . . . 0.0 109.52 179.525 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.934 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -79.16 -70.2 0.52 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.395 -0.815 . . . . 0.0 110.941 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.574 ' HE1' HG13 ' A' ' 123' ' ' VAL . 0.7 OUTLIER -56.63 -26.7 56.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.114 -0.991 . . . . 0.0 110.105 -179.487 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.426 ' O ' ' C ' ' A' ' 80' ' ' LEU . 61.2 m -63.65 -65.2 0.71 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.031 -1.043 . . . . 0.0 109.439 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.766 HD11 HG21 ' A' ' 43' ' ' ILE . 10.6 tp -42.67 -59.0 2.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.502 -0.748 . . . . 0.0 109.316 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.483 ' HE2' ' SG ' ' A' ' 96' ' ' CYS . 19.4 ttt -42.9 -46.08 5.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.359 -0.838 . . . . 0.0 109.836 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.653 ' HB2' HD12 ' A' ' 130' ' ' LEU . 40.8 tt0 -58.81 -48.57 80.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.356 -0.84 . . . . 0.0 109.779 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.424 ' CE1' HG21 ' A' ' 87' ' ' THR . 22.9 t80 -54.48 -37.39 65.2 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.41 -0.806 . . . . 0.0 110.183 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.92 ' HB2' HG11 ' A' ' 92' ' ' VAL . 2.6 mt -74.67 -28.45 60.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.273 -0.892 . . . . 0.0 110.007 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.994 HD13 HD11 ' A' ' 134' ' ' LEU . 32.2 mt -70.22 -26.05 28.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.037 -1.039 . . . . 0.0 109.962 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -88.77 -68.68 0.75 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.261 -0.9 . . . . 0.0 110.383 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.438 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 14.5 t -95.1 -22.73 17.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.201 -0.937 . . . . 0.0 110.49 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.585 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -47.68 -77.17 0.12 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 88' ' ' GLY . 6.2 p -178.71 171.45 1.48 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.169 -1.195 . . . . 0.0 110.301 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -71.47 -13.8 61.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.272 -0.892 . . . . 0.0 110.219 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 15.7 mmt180 -79.48 -41.51 27.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.25 -0.906 . . . . 0.0 109.989 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.92 HG11 ' HB2' ' A' ' 84' ' ' LEU . 93.3 t -56.26 -33.24 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.263 -0.898 . . . . 0.0 109.865 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.47 ' O ' ' HB3' ' A' ' 96' ' ' CYS . 1.6 t -76.15 -40.97 51.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.289 -0.882 . . . . 0.0 109.849 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -57.18 -56.58 19.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -0.869 . . . . 0.0 109.861 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -52.92 -38.75 62.22 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.361 -0.837 . . . . 0.0 109.568 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.483 ' SG ' ' HE2' ' A' ' 81' ' ' MET . 48.9 t -54.67 -43.84 72.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.359 -0.838 . . . . 0.0 109.693 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -65.44 -35.81 82.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.352 -0.842 . . . . 0.0 109.675 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -78.24 -12.68 60.01 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.421 -0.799 . . . . 0.0 109.842 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -134.04 30.41 3.65 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.458 -0.776 . . . . 0.0 110.119 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 4.9 ptt? -62.99 -24.92 68.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.178 -0.951 . . . . 0.0 110.009 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.469 ' O ' ' HB ' ' A' ' 105' ' ' THR . 2.7 m-85 -65.76 -23.84 66.82 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.213 -0.929 . . . . 0.0 109.99 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.991 ' O ' HG22 ' A' ' 105' ' ' THR . . . -78.37 -40.89 34.91 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.381 -0.825 . . . . 0.0 110.193 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.701 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 5.3 t -72.17 -27.64 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.306 -0.871 . . . . 0.0 110.151 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.78 ' HG2' HG21 ' A' ' 131' ' ' VAL . 3.4 mm100 -86.84 -29.36 22.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.327 -0.858 . . . . 0.0 110.372 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.991 HG22 ' O ' ' A' ' 102' ' ' ALA . 11.0 t -57.59 -19.38 25.45 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.236 -0.915 . . . . 0.0 110.232 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.99 HD11 HD22 ' A' ' 64' ' ' LEU . 20.4 mt -68.97 -40.65 78.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.251 -0.906 . . . . 0.0 110.255 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 14.9 ttpp . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.235 -0.916 . . . . 0.0 110.196 179.836 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.564 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.2 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.282 0.563 . . . . 0.0 110.071 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.564 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.6 m-80 -36.6 -30.11 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.218 0.533 . . . . 0.0 110.64 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.744 HG13 HG12 ' A' ' 74' ' ' VAL . 12.6 t -72.7 -62.12 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.339 -0.851 . . . . 0.0 110.283 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -44.47 -43.82 8.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.251 -0.905 . . . . 0.0 110.658 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.539 ' HG3' ' N ' ' A' ' 126' ' ' LYS . 10.0 pt-20 -75.39 -32.22 60.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.276 -0.89 . . . . 0.0 110.717 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.539 ' N ' ' HG3' ' A' ' 125' ' ' GLU . 33.4 tptt -62.07 -52.89 62.08 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.97 -1.081 . . . . 0.0 110.247 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.701 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -58.26 -41.42 84.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.302 -0.874 . . . . 0.0 110.267 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 11.6 tttm -59.67 -38.29 81.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.23 -0.919 . . . . 0.0 110.305 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -62.32 -40.62 96.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.281 -0.887 . . . . 0.0 110.6 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.653 HD12 ' HB2' ' A' ' 82' ' ' GLU . 7.9 tt -61.17 -40.39 93.71 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.08 -1.012 . . . . 0.0 110.508 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.78 HG21 ' HG2' ' A' ' 104' ' ' GLN . 54.0 t -77.45 -24.96 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.321 -0.862 . . . . 0.0 110.475 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.0 -52.61 18.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.234 -0.916 . . . . 0.0 110.573 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.742 HD12 ' C ' ' A' ' 133' ' ' LEU . 3.5 pp -66.31 -22.16 66.28 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.181 -0.95 . . . . 0.0 110.371 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.994 HD11 HD13 ' A' ' 85' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 O-C-N 121.268 -0.895 . . . . 0.0 110.466 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 121.242 0.544 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.913 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -60.42 -45.58 93.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.266 -0.896 . . . . 0.0 110.286 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.501 ' HG3' HG13 ' A' ' 22' ' ' ILE . 9.4 pt-20 -43.39 -40.94 3.93 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 110.051 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.501 HG13 ' HG3' ' A' ' 21' ' ' GLU . 37.3 mt -69.45 -40.46 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.2 -0.938 . . . . 0.0 109.968 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 1.0 OUTLIER -59.53 -61.72 2.41 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.287 -0.883 . . . . 0.0 110.122 179.814 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.829 HG13 HD23 ' A' ' 80' ' ' LEU . 84.2 t -48.35 -33.33 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.241 -0.912 . . . . 0.0 110.052 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.415 ' HB3' ' O ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER -64.6 -46.39 82.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.374 -0.829 . . . . 0.0 110.244 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.01 -17.13 61.03 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.384 -0.822 . . . . 0.0 110.19 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.942 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -79.7 -28.1 40.67 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 110.152 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 77.4 p . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.24 -0.912 . . . . 0.0 110.142 179.898 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.942 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.27 0.557 . . . . 0.0 110.18 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.0 mtp -66.99 -52.36 43.57 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.275 -0.891 . . . . 0.0 110.149 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 t -55.04 -32.08 61.6 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.269 -0.894 . . . . 0.0 110.221 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.94 -46.4 52.7 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.257 -0.902 . . . . 0.0 110.218 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.468 ' O ' ' HB2' ' A' ' 46' ' ' LEU . 68.6 mt -59.81 -31.01 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.129 -0.982 . . . . 0.0 109.853 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.577 ' HA ' HD22 ' A' ' 84' ' ' LEU . . . -70.65 -51.43 27.94 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.135 -0.978 . . . . 0.0 109.434 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.435 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 38.4 t0 -52.68 -21.08 3.6 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.076 -1.015 . . . . 0.0 108.886 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.913 HD13 ' CB ' ' A' ' 20' ' ' ALA . 15.5 mt -79.81 -38.31 33.23 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.488 -0.757 . . . . 0.0 110.247 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.535 ' HA ' ' CA ' ' A' ' 53' ' ' PHE . 55.3 p -52.49 -45.41 66.15 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.946 -1.096 . . . . 0.0 109.063 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.435 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 90.4 m-85 -43.58 -41.98 4.84 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.38 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.535 ' O ' ' N ' ' A' ' 51' ' ' VAL . 0.3 OUTLIER -73.51 91.43 1.81 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.577 -0.702 . . . . 0.0 110.183 179.531 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.532 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.09 -59.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.571 178.309 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.544 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -65.05 -65.78 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.104 -0.998 . . . . 0.0 110.203 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.811 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -35.64 -46.56 0.43 Allowed 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.099 -177.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.535 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 4.7 t80 -55.4 -56.75 16.58 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.279 -0.888 . . . . 0.0 110.289 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.488 ' O ' ' HB2' ' A' ' 58' ' ' SER . 88.9 p -52.1 -38.88 58.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.206 -0.934 . . . . 0.0 110.245 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -70.14 -29.73 66.73 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.431 -0.793 . . . . 0.0 110.39 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.79 ' HA ' HG21 ' A' ' 24' ' ' VAL . 11.2 mt -77.55 -70.28 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.187 -0.946 . . . . 0.0 110.281 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.54 ' HG3' ' NE1' ' A' ' 61' ' ' TRP . 1.9 tpt -47.19 -34.6 6.48 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.144 -0.972 . . . . 0.0 110.031 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 54' ' ' SER . 32.5 t -57.23 -61.82 2.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.333 -0.854 . . . . 0.0 110.108 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.4 mmt -58.21 -26.62 63.06 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.199 -0.938 . . . . 0.0 109.941 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.773 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -71.6 -31.07 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.299 -0.876 . . . . 0.0 109.88 179.747 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.54 ' NE1' ' HG3' ' A' ' 57' ' ' MET . 11.0 m95 -77.47 -42.93 34.07 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.277 -0.889 . . . . 0.0 110.386 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -60.5 3.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.283 -0.886 . . . . 0.0 110.605 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -13.04 57.96 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.187 -0.946 . . . . 0.0 110.578 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 1.022 HD22 HD11 ' A' ' 106' ' ' LEU . 2.4 mt -74.99 -13.43 60.51 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.162 -0.961 . . . . 0.0 110.576 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 . . . . . 0 C--N 1.303 -1.456 0 O-C-N 121.15 -0.969 . . . . 0.0 110.379 -179.625 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.47 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 33.7 p-90 . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.273 0.559 . . . . 0.0 110.096 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.411 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 14.9 mtt180 -50.69 -42.98 57.46 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.242 -0.911 . . . . 0.0 109.945 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.3 m170 -54.56 -39.62 67.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.321 -0.862 . . . . 0.0 109.835 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.756 HG11 ' CG1' ' A' ' 123' ' ' VAL . 42.7 t -60.64 -51.27 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.314 -0.866 . . . . 0.0 109.759 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 74' ' ' VAL . 2.2 t80 -41.79 -61.55 1.08 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.393 -0.817 . . . . 0.0 110.261 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.03 -28.98 70.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.271 -0.893 . . . . 0.0 110.195 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.949 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -61.24 -70.32 0.19 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.185 -0.947 . . . . 0.0 110.166 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.656 ' HE2' HG12 ' A' ' 74' ' ' VAL . 3.0 ptp -50.49 -26.61 5.33 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.398 -0.814 . . . . 0.0 110.023 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 61.2 m -66.68 -47.27 72.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.272 -0.892 . . . . 0.0 109.937 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.829 HD23 HG13 ' A' ' 24' ' ' VAL . 16.6 tp -64.22 -29.7 70.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.428 -0.795 . . . . 0.0 109.838 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.788 ' HG2' HD21 ' A' ' 130' ' ' LEU . 5.2 ttp -71.86 -35.17 69.74 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.333 -0.854 . . . . 0.0 109.893 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.44 ' CB ' HD13 ' A' ' 130' ' ' LEU . 46.2 tt0 -70.87 -56.41 6.34 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.298 -0.876 . . . . 0.0 110.22 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -52.56 -45.06 66.25 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.289 -0.882 . . . . 0.0 110.74 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.608 ' CB ' HG11 ' A' ' 92' ' ' VAL . 59.8 mt -73.0 -29.68 63.21 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.935 . . . . 0.0 110.791 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.635 HG13 HG12 ' A' ' 92' ' ' VAL . 8.5 mt -61.19 -14.28 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 120.859 -1.151 . . . . 0.0 109.635 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 43.0 mttt -107.03 -77.76 0.59 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.241 -0.912 . . . . 0.0 109.97 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.459 HG23 ' HB1' ' A' ' 44' ' ' ALA . 13.5 t -82.49 2.88 30.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.881 . . . . 0.0 110.019 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -93.39 30.06 7.66 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.2 OUTLIER 75.74 148.59 0.1 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.58 -0.953 . . . . 0.0 110.41 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.3 -9.72 13.01 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.48 -0.763 . . . . 0.0 110.542 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 -71.46 -43.13 67.19 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.184 -0.948 . . . . 0.0 109.836 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.635 HG12 HG13 ' A' ' 85' ' ' ILE . 99.3 t -55.98 -32.85 34.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.481 -0.762 . . . . 0.0 110.324 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.514 ' OG ' HG23 ' A' ' 85' ' ' ILE . 1.1 t -81.56 -41.81 21.05 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.239 -0.913 . . . . 0.0 110.27 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -55.12 -54.18 46.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.0 109.961 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.483 ' HG2' ' HE2' ' A' ' 57' ' ' MET . 11.1 tt0 -54.18 -39.46 66.62 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.408 -0.807 . . . . 0.0 109.657 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.554 ' SG ' HD11 ' A' ' 134' ' ' LEU . 0.1 OUTLIER -55.26 -43.01 74.27 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.318 -0.864 . . . . 0.0 109.644 179.527 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -68.12 -31.22 70.66 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.435 -0.791 . . . . 0.0 109.704 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -75.62 -19.84 58.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.432 -0.793 . . . . 0.0 109.798 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -122.07 40.67 3.59 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.411 -0.806 . . . . 0.0 110.033 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . 0.458 ' O ' ' HB2' ' A' ' 104' ' ' GLN . 0.2 OUTLIER -56.15 -22.64 29.92 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.27 -0.894 . . . . 0.0 110.343 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.443 ' N ' ' HG2' ' A' ' 100' ' ' MET . 2.3 m-30 -76.57 -32.26 58.06 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -0.916 . . . . 0.0 110.256 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.816 ' O ' HG22 ' A' ' 105' ' ' THR . . . -74.5 -39.41 62.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 110.219 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.733 HG23 ' CE ' ' A' ' 81' ' ' MET . 3.2 p -74.26 -42.43 50.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 O-C-N 121.287 -0.883 . . . . 0.0 109.304 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.568 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 67.3 mt-30 -71.94 -20.16 61.8 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.596 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.816 HG22 ' O ' ' A' ' 102' ' ' ALA . 5.1 t -53.34 -28.28 27.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.951 -1.093 . . . . 0.0 110.056 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 1.022 HD11 HD22 ' A' ' 64' ' ' LEU . 75.5 mt -71.94 -35.32 69.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.874 . . . . 0.0 110.263 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.511 ' HA ' ' HG2' ' A' ' 124' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.625 0 O-C-N 121.234 -0.916 . . . . 0.0 110.087 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.563 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.7 p . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.301 0.572 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.563 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.2 m-20 -37.43 -28.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.76 -0.588 . . . . 0.0 110.76 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.756 ' CG1' HG11 ' A' ' 74' ' ' VAL . 7.1 t -85.29 -64.73 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.243 -0.91 . . . . 0.0 110.211 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.511 ' HG2' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -40.6 -36.27 0.57 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.146 -0.971 . . . . 0.0 111.05 -179.467 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.47 ' O ' ' HB3' ' A' ' 128' ' ' LYS . 17.5 mm-40 -81.36 -50.81 9.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.119 -0.988 . . . . 0.0 111.191 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.452 ' HB3' ' SD ' ' A' ' 78' ' ' MET . 0.0 OUTLIER -53.59 -56.78 14.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.075 -1.016 . . . . 0.0 109.73 -179.786 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.571 ' O ' HG23 ' A' ' 131' ' ' VAL . . . -53.78 -41.36 67.16 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.398 -0.814 . . . . 0.0 110.058 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -50.78 -40.7 55.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.125 -0.984 . . . . 0.0 110.175 179.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -65.21 -53.1 49.64 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 110.177 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.788 HD21 ' HG2' ' A' ' 81' ' ' MET . 17.1 tp -48.58 -32.03 7.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.216 -0.928 . . . . 0.0 110.13 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 127' ' ' ALA . 21.4 t -78.73 -35.05 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.391 -0.818 . . . . 0.0 110.106 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.78 -52.71 55.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 0.0 110.185 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.19 -44.6 83.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.3 -0.875 . . . . 0.0 110.186 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.554 HD11 ' SG ' ' A' ' 96' ' ' CYS . 5.9 mt . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.246 -0.909 . . . . 0.0 110.346 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.283 0.563 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.559 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -72.46 -42.35 65.07 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.186 -0.946 . . . . 0.0 110.265 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.476 ' HG3' HG12 ' A' ' 22' ' ' ILE . 17.2 pt-20 -43.23 -34.41 1.15 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.257 -0.902 . . . . 0.0 110.01 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.476 HG12 ' HG3' ' A' ' 21' ' ' GLU . 25.0 mm -79.83 -50.24 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.383 -0.823 . . . . 0.0 109.811 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.776 ' O ' HD11 ' A' ' 43' ' ' ILE . 4.1 mptt -48.76 -27.99 3.33 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.281 -0.887 . . . . 0.0 110.096 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.757 HG21 ' HA ' ' A' ' 56' ' ' ILE . 91.6 t -85.42 -33.62 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.263 -0.898 . . . . 0.0 110.014 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -62.87 -43.27 99.24 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.249 -0.907 . . . . 0.0 109.921 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -33.31 61.76 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.484 -0.76 . . . . 0.0 110.061 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.629 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -64.57 -23.17 67.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.333 -0.854 . . . . 0.0 110.13 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.476 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 40.7 p . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.241 -0.912 . . . . 0.0 110.223 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.885 ' O ' HD12 ' A' ' 43' ' ' ILE . 4.5 tp . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 121.157 0.503 . . . . 0.0 110.712 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 2.9 mtt -96.71 -43.7 7.43 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.186 -0.946 . . . . 0.0 109.869 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.0 t -67.33 -28.8 68.28 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.334 -0.854 . . . . 0.0 110.374 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.46 ' O ' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -73.4 -50.37 22.17 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.25 -0.906 . . . . 0.0 110.359 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.935 HG21 HD11 ' A' ' 80' ' ' LEU . 20.9 mt -56.34 -36.62 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.234 -0.916 . . . . 0.0 110.272 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.751 ' CB ' HG23 ' A' ' 87' ' ' THR . . . -70.05 -48.49 57.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.064 -1.023 . . . . 0.0 109.486 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.462 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -53.49 -20.68 5.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.047 -1.033 . . . . 0.0 108.995 178.856 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.741 ' HB3' HD11 ' A' ' 56' ' ' ILE . 15.6 mt -81.5 -36.91 28.69 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.499 -0.751 . . . . 0.0 109.884 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.516 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 67.9 p -51.92 -43.42 63.41 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.269 -0.972 . . . . 0.0 109.038 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 93.4 m-85 -45.02 -43.3 9.11 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.433 -0.907 . . . . 0.0 109.399 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 50' ' ' VAL . 0.8 OUTLIER -71.78 90.47 1.09 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.551 -0.718 . . . . 0.0 110.51 179.631 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.02 -58.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.609 178.175 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.544 HG12 ' N ' ' A' ' 52' ' ' ALA . 3.0 t -66.11 -66.26 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.052 -1.03 . . . . 0.0 110.345 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.62 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -35.46 -42.9 0.23 Allowed 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.16 0.505 . . . . 0.0 110.833 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.593 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 32.0 t80 -58.91 -55.16 38.69 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.413 -0.804 . . . . 0.0 110.21 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.7 t -53.92 -28.18 35.34 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.316 -0.865 . . . . 0.0 109.924 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.38 -30.37 37.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.297 -0.877 . . . . 0.0 109.997 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.757 ' HA ' HG21 ' A' ' 24' ' ' VAL . 6.7 mt -75.89 -65.8 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.398 -0.814 . . . . 0.0 109.963 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.593 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 89.4 mmm -45.94 -34.49 3.97 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.21 -0.931 . . . . 0.0 109.792 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.6 m -57.7 -63.99 1.05 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.333 -0.854 . . . . 0.0 110.108 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.471 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.4 OUTLIER -57.93 -20.21 35.78 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.946 . . . . 0.0 110.104 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.786 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -79.67 -30.6 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.337 -0.852 . . . . 0.0 109.979 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.56 ' CD1' ' O ' ' A' ' 57' ' ' MET . 21.6 m95 -80.94 -44.74 17.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.162 -0.962 . . . . 0.0 110.162 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.73 -44.37 85.95 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.289 -0.882 . . . . 0.0 109.813 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -73.75 -14.42 61.12 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.0 109.942 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.921 HD22 HD11 ' A' ' 106' ' ' LEU . 10.1 mt -85.0 -19.49 31.94 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.304 -0.872 . . . . 0.0 110.312 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.404 0 O-C-N 121.247 -0.908 . . . . 0.0 110.141 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.551 ' CZ3' ' HA ' ' A' ' 72' ' ' ARG . 21.7 p-90 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.116 0.484 . . . . 0.0 110.12 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.551 ' HA ' ' CZ3' ' A' ' 71' ' ' TRP . 11.8 ptm180 -42.83 -33.18 0.72 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.309 -0.87 . . . . 0.0 110.138 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.425 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 0.6 OUTLIER -68.28 -48.58 64.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.197 -0.939 . . . . 0.0 109.961 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.606 HG12 HG22 ' A' ' 123' ' ' VAL . 79.5 t -53.53 -50.78 47.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 0.0 109.978 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.629 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 2.8 t80 -50.42 -58.97 4.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.215 -0.928 . . . . 0.0 109.979 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.476 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 4.9 mttt -56.62 -25.3 52.72 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.363 -0.836 . . . . 0.0 110.09 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.794 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -73.85 -34.19 64.4 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.89 . . . . 0.0 110.207 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.718 ' HE1' HG13 ' A' ' 123' ' ' VAL . 0.4 OUTLIER -65.59 -34.73 78.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.346 -0.846 . . . . 0.0 110.029 179.841 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 44.5 m -67.99 -59.68 3.08 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 110.317 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.935 HD11 HG21 ' A' ' 43' ' ' ILE . 25.6 tp -47.51 -55.1 9.82 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.31 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 1.051 ' HG2' HD21 ' A' ' 130' ' ' LEU . 2.0 tpt -51.3 -35.57 38.4 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.113 -0.992 . . . . 0.0 110.29 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.753 ' HA ' HD12 ' A' ' 85' ' ' ILE . 26.4 tt0 -71.31 -64.86 0.83 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.183 -0.948 . . . . 0.0 110.418 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 1.098 ' CE1' HG21 ' A' ' 87' ' ' THR . 45.3 t80 -43.8 -38.05 3.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.207 -0.933 . . . . 0.0 110.955 -179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.687 HD23 ' HB2' ' A' ' 44' ' ' ALA . 68.8 mt -76.81 -34.36 57.94 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.124 -0.985 . . . . 0.0 110.751 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.016 HD13 HD21 ' A' ' 134' ' ' LEU . 10.6 mt -50.89 -21.2 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.924 -1.11 . . . . 0.0 109.722 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.69 -77.45 0.57 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.232 -0.917 . . . . 0.0 110.156 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 1.098 HG21 ' CE1' ' A' ' 83' ' ' TYR . 13.0 t -61.85 -13.92 28.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.251 -0.906 . . . . 0.0 110.147 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.668 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -88.82 30.9 5.19 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.495 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 71.47 157.15 0.17 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.318 -1.107 . . . . 0.0 110.431 179.961 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -66.95 -7.19 20.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.424 -0.798 . . . . 0.0 110.485 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -73.09 -40.38 65.05 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 0.0 109.714 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.685 HG11 ' CB ' ' A' ' 84' ' ' LEU . 86.8 t -61.09 -35.15 63.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.315 -0.866 . . . . 0.0 109.855 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.4 t -75.51 -43.84 46.87 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.156 -0.965 . . . . 0.0 109.678 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -56.79 -37.5 71.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.0 109.603 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -65.22 -41.51 94.37 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.348 -0.845 . . . . 0.0 109.288 179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.427 ' SG ' ' HE2' ' A' ' 81' ' ' MET . 4.6 t -54.22 -42.21 69.55 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.333 -0.854 . . . . 0.0 109.236 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.59 -34.17 77.6 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.505 -0.747 . . . . 0.0 109.351 179.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -78.77 -13.68 59.68 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.532 -0.73 . . . . 0.0 109.702 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -134.51 35.52 3.18 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.461 -0.774 . . . . 0.0 110.017 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.8 mtm -63.04 -28.44 70.1 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.245 -0.91 . . . . 0.0 110.133 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.47 ' O ' ' HB ' ' A' ' 105' ' ' THR . 44.0 m-85 -63.04 -22.66 67.01 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -0.89 . . . . 0.0 109.935 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.953 ' O ' HG22 ' A' ' 105' ' ' THR . . . -77.56 -41.12 40.07 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.309 -0.869 . . . . 0.0 110.069 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.498 HG13 HD23 ' A' ' 130' ' ' LEU . 3.4 t -74.75 -26.46 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.392 -0.817 . . . . 0.0 109.967 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.485 ' OE1' HG21 ' A' ' 131' ' ' VAL . 17.4 mm100 -85.64 -25.96 26.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.303 -0.873 . . . . 0.0 110.153 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.953 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.5 t -62.19 -23.88 66.87 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.241 -0.912 . . . . 0.0 110.154 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.921 HD11 HD22 ' A' ' 64' ' ' LEU . 13.5 mt -65.03 -40.51 94.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.186 -0.946 . . . . 0.0 110.177 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.409 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 13.7 ttpp . . . . . 0 N--CA 1.49 1.575 0 O-C-N 121.181 -0.949 . . . . 0.0 109.884 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.814 HG22 ' OE1' ' A' ' 125' ' ' GLU . 4.2 p . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 121.473 0.654 . . . . 0.0 110.376 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.577 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 3.1 m-80 -46.26 -31.41 2.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.213 -0.929 . . . . 0.0 110.258 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.718 HG13 ' HE1' ' A' ' 78' ' ' MET . 2.0 t -83.13 -55.2 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.25 -0.906 . . . . 0.0 110.361 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.42 ' N ' HG12 ' A' ' 123' ' ' VAL . 2.2 tmt_? -47.74 -49.78 27.32 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.009 -1.057 . . . . 0.0 111.073 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.814 ' OE1' HG22 ' A' ' 121' ' ' VAL . 21.4 mt-10 -64.85 -53.22 50.2 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.257 -0.902 . . . . 0.0 111.505 -179.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.629 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -50.13 -45.43 52.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.982 -1.074 . . . . 0.0 110.682 -179.242 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.24 -42.93 83.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.22 -0.925 . . . . 0.0 110.396 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -45.9 -55.99 6.01 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.184 -0.948 . . . . 0.0 110.276 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -58.56 -51.1 71.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 0.0 110.333 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 1.051 HD21 ' HG2' ' A' ' 81' ' ' MET . 25.6 tp -46.09 -27.78 1.04 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.246 -0.909 . . . . 0.0 110.316 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.485 HG21 ' OE1' ' A' ' 104' ' ' GLN . 25.6 t -89.87 -33.87 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.208 -0.933 . . . . 0.0 110.284 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.82 -58.26 6.04 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.23 -0.919 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.6 tt -51.63 -39.5 58.2 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.22 -0.925 . . . . 0.0 110.241 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 1.02 HD23 ' O ' ' A' ' 130' ' ' LEU . 2.9 mm? . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 110.182 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.174 0.512 . . . . 0.0 110.305 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.76 ' HA ' HD13 ' A' ' 46' ' ' LEU . . . -64.67 -44.52 90.1 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.266 -0.896 . . . . 0.0 110.178 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.402 ' HG3' HG12 ' A' ' 22' ' ' ILE . 11.1 pt-20 -55.52 -42.87 75.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.177 -0.952 . . . . 0.0 110.292 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.402 HG12 ' HG3' ' A' ' 21' ' ' GLU . 25.1 mm -63.68 -53.87 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.288 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HB3' HG13 ' A' ' 43' ' ' ILE . 28.7 mmtm -50.74 -58.97 4.62 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.207 -0.933 . . . . 0.0 110.349 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.91 HG21 ' HA ' ' A' ' 56' ' ' ILE . 38.2 t -45.0 -44.52 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.0 110.447 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -38.64 91.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.118 -0.989 . . . . 0.0 110.334 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -72.03 -20.66 61.66 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.322 -0.861 . . . . 0.0 110.055 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.758 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -86.81 -15.94 37.7 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.198 -0.939 . . . . 0.0 110.05 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.505 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 14.0 p . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.33 -0.856 . . . . 0.0 110.102 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.758 HD23 ' HB2' ' A' ' 27' ' ' ALA . 1.6 tp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.259 0.552 . . . . 0.0 110.209 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -60.68 3.41 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.221 -0.925 . . . . 0.0 110.264 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.564 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 14.1 m -46.87 -28.29 1.53 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.202 -0.936 . . . . 0.0 110.216 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HB3' ' O ' ' A' ' 39' ' ' LEU . 19.5 tp10 -71.92 -50.74 26.51 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.305 -0.872 . . . . 0.0 110.249 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.596 HG21 HD11 ' A' ' 80' ' ' LEU . 8.1 mt -54.91 -31.46 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.137 -0.977 . . . . 0.0 110.03 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.537 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.48 -53.4 16.42 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.248 -0.908 . . . . 0.0 109.547 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.523 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER -53.15 -20.88 4.28 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.02 -1.05 . . . . 0.0 109.044 179.112 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.809 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 11.0 mt -80.66 -37.16 31.4 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.522 -0.736 . . . . 0.0 110.108 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.63 HG21 HG21 ' A' ' 92' ' ' VAL . 68.8 p -53.54 -43.14 68.17 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.031 -1.043 . . . . 0.0 109.29 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.523 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 92.6 m-85 -43.57 -41.23 4.43 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.394 -0.816 . . . . 0.0 109.523 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.536 ' O ' ' N ' ' A' ' 51' ' ' VAL . 0.5 OUTLIER -74.69 93.1 2.51 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.427 -0.796 . . . . 0.0 110.247 179.459 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.532 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.42 -57.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.535 178.262 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.541 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.8 t -64.48 -65.69 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.018 -1.051 . . . . 0.0 110.359 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.809 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.84 -48.87 1.16 Allowed 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.051 -177.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.573 ' HA ' HD12 ' A' ' 56' ' ' ILE . 2.6 t80 -55.15 -53.32 57.46 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.198 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 58' ' ' SER . 1.1 t -57.41 -26.31 60.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.179 -0.951 . . . . 0.0 110.416 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -87.58 -20.45 26.4 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.171 -0.955 . . . . 0.0 110.492 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.91 ' HA ' HG21 ' A' ' 24' ' ' VAL . 10.8 mt -78.99 -70.09 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.192 -0.942 . . . . 0.0 110.316 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.511 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 9.6 mtp -50.92 -36.79 40.24 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.174 -0.954 . . . . 0.0 109.897 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.482 ' HB2' ' O ' ' A' ' 54' ' ' SER . 42.3 t -54.37 -59.99 3.95 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.274 -0.891 . . . . 0.0 109.761 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.42 ' HA ' ' HD3' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -58.83 -28.9 66.48 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.336 -0.852 . . . . 0.0 109.587 179.488 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.768 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -66.99 -31.65 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.458 -0.776 . . . . 0.0 109.624 179.699 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.55 ' CH2' ' HE3' ' A' ' 81' ' ' MET . 41.6 m95 -76.04 -47.41 24.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.183 -0.948 . . . . 0.0 110.191 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.42 ' HD3' ' HA ' ' A' ' 59' ' ' MET . 5.9 mttt -49.86 -61.9 1.87 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.347 -0.845 . . . . 0.0 110.393 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 20.4 mmt-85 -64.27 -19.84 65.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.244 -0.91 . . . . 0.0 110.19 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.994 ' CD2' HD11 ' A' ' 106' ' ' LEU . 3.2 mt -70.73 -20.41 62.64 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.169 -0.957 . . . . 0.0 110.332 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 . . . . . 0 C--N 1.305 -1.362 0 O-C-N 121.188 -0.945 . . . . 0.0 110.218 -179.855 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.577 ' CZ3' ' HG3' ' A' ' 72' ' ' ARG . 46.1 p-90 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.212 0.529 . . . . 0.0 110.308 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.577 ' HG3' ' CZ3' ' A' ' 71' ' ' TRP . 0.9 OUTLIER -53.75 -42.01 67.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.208 -0.933 . . . . 0.0 110.232 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -66.05 -39.81 90.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.2 -0.938 . . . . 0.0 110.244 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.73 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 9.6 t -55.49 -57.12 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.178 -0.951 . . . . 0.0 110.175 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.625 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 17.3 t80 -48.77 -66.77 0.34 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -0.924 . . . . 0.0 110.019 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.505 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.3 OUTLIER -49.22 -25.29 2.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.366 -0.834 . . . . 0.0 109.963 179.851 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.826 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -67.75 -50.71 55.82 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.278 -0.889 . . . . 0.0 110.172 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.758 ' SD ' HD21 ' A' ' 64' ' ' LEU . 3.2 mpp? -54.91 -29.79 56.83 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.358 -0.839 . . . . 0.0 110.198 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.402 ' O ' ' HB3' ' A' ' 82' ' ' GLU . 2.6 m -67.59 -53.88 24.47 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.355 -0.841 . . . . 0.0 110.527 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.768 ' CD2' HD11 ' A' ' 60' ' ' ILE . 21.0 tp -55.84 -53.33 58.04 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.224 -0.922 . . . . 0.0 110.106 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.776 ' SD ' HD21 ' A' ' 130' ' ' LEU . 0.4 OUTLIER -55.0 -24.99 26.95 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.095 -1.003 . . . . 0.0 110.446 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.687 ' HB2' HD12 ' A' ' 130' ' ' LEU . 2.8 tt0 -79.37 -59.44 2.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.066 -1.021 . . . . 0.0 110.436 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.586 ' CE1' HG21 ' A' ' 87' ' ' THR . 17.8 t80 -53.45 -31.35 45.11 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.423 -0.798 . . . . 0.0 111.013 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.823 ' CB ' HG11 ' A' ' 92' ' ' VAL . 73.9 mt -77.87 -29.98 50.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 0.0 110.638 -179.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.878 HD13 HD11 ' A' ' 134' ' ' LEU . 26.5 mt -64.09 -11.59 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.087 -1.008 . . . . 0.0 109.974 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -107.43 -72.35 0.72 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.27 -0.894 . . . . 0.0 110.168 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.586 HG21 ' CE1' ' A' ' 83' ' ' TYR . 12.2 t -89.16 1.3 55.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.15 -0.969 . . . . 0.0 110.189 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.613 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -91.35 28.1 8.62 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.5 OUTLIER 75.06 149.29 0.1 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.562 -0.964 . . . . 0.0 110.114 -179.822 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.74 -10.3 12.33 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.391 -0.818 . . . . 0.0 110.635 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 73.8 mtp85 -70.32 -45.82 65.46 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.059 -1.026 . . . . 0.0 109.647 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.823 HG11 ' CB ' ' A' ' 84' ' ' LEU . 96.9 t -52.56 -30.94 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 O-C-N 121.488 -0.758 . . . . 0.0 110.039 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.548 ' OG ' HD21 ' A' ' 134' ' ' LEU . 21.0 t -81.23 -37.39 28.66 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.323 -0.861 . . . . 0.0 109.884 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.409 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 24.4 mm-40 -56.61 -52.55 64.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -0.873 . . . . 0.0 109.927 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.443 ' HB3' ' SD ' ' A' ' 57' ' ' MET . 7.0 tp60 -57.26 -36.95 71.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.465 -0.772 . . . . 0.0 109.594 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.6 t -57.22 -39.64 75.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.272 -0.892 . . . . 0.0 109.651 179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -71.79 -30.3 65.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.497 -0.752 . . . . 0.0 109.66 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 61.9 mt-10 -83.94 -11.83 56.27 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.453 -0.779 . . . . 0.0 110.029 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -128.41 32.08 4.91 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.375 -0.828 . . . . 0.0 110.133 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.4 ppp? -63.9 -20.44 65.85 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.263 -0.898 . . . . 0.0 110.118 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.484 ' O ' ' HB ' ' A' ' 105' ' ' THR . 31.6 m-85 -75.97 -20.85 57.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.277 -0.889 . . . . 0.0 110.274 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.951 ' O ' HG22 ' A' ' 105' ' ' THR . . . -85.72 -39.85 16.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.155 -0.966 . . . . 0.0 110.106 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.618 HG11 HG22 ' A' ' 131' ' ' VAL . 3.6 p -73.93 -41.91 53.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.637 0 CA-C-O 122.033 0.92 . . . . 0.0 109.141 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.568 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 3.7 mm-40 -69.42 -24.51 63.85 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.68 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 102' ' ' ALA . 5.0 t -59.53 -27.77 66.48 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.953 -1.092 . . . . 0.0 109.932 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.994 HD11 ' CD2' ' A' ' 64' ' ' LEU . 61.8 mt -59.44 -37.74 78.89 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.324 -0.86 . . . . 0.0 110.144 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.413 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 34.8 ttpt . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.021 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.54 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.0 p . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 121.341 0.591 . . . . 0.0 110.149 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.54 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 15.3 m-20 -36.36 -29.1 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.877 -0.514 . . . . 0.0 111.022 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.606 HG13 ' CG1' ' A' ' 74' ' ' VAL . 12.0 t -73.72 -64.72 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.122 -0.986 . . . . 0.0 110.358 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.413 ' HG3' ' HA ' ' A' ' 107' ' ' LYS . 35.5 ttp180 -51.96 -31.25 28.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.256 -0.902 . . . . 0.0 110.77 -179.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.467 ' HG3' HG22 ' A' ' 121' ' ' VAL . 11.5 mt-10 -76.31 -46.98 25.25 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.173 -0.955 . . . . 0.0 110.617 -179.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.625 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -55.43 -49.71 71.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.99 . . . . 0.0 110.257 -179.763 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.564 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -66.33 -41.31 89.78 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.305 -0.872 . . . . 0.0 110.712 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -34.25 73.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.178 -0.951 . . . . 0.0 110.762 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -77.67 -28.54 51.17 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.183 -0.948 . . . . 0.0 110.861 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.776 HD21 ' SD ' ' A' ' 81' ' ' MET . 5.1 tt -68.74 -48.0 64.89 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.134 -0.979 . . . . 0.0 110.282 -179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.618 HG22 HG11 ' A' ' 103' ' ' VAL . 5.3 t -69.4 -28.18 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.261 -0.899 . . . . 0.0 110.137 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.48 -47.12 57.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.852 . . . . 0.0 110.432 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.98 -33.56 70.82 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.18 -0.95 . . . . 0.0 110.4 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.878 HD11 HD13 ' A' ' 85' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.168 -0.958 . . . . 0.0 110.425 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.429 ' O ' ' HB ' ' A' ' 22' ' ' ILE . 50.7 mt-10 . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.23 0.538 . . . . 0.0 110.491 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.785 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -56.86 -54.59 44.71 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.156 -0.965 . . . . 0.0 110.129 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' A' ' 20' ' ' ALA . 5.7 pt-20 -43.75 -26.49 0.25 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.095 -1.003 . . . . 0.0 109.975 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 19' ' ' GLU . 21.5 mm -77.72 -49.01 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.293 -0.879 . . . . 0.0 110.074 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.67 -42.94 75.83 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.296 -0.878 . . . . 0.0 110.138 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.717 HG13 ' CD2' ' A' ' 80' ' ' LEU . 78.4 t -65.43 -41.96 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.249 -0.907 . . . . 0.0 110.048 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -50.42 -44.86 55.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.197 -0.939 . . . . 0.0 110.159 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -79.04 -26.98 43.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.382 -0.824 . . . . 0.0 110.188 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.795 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -64.42 -23.06 67.16 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.166 -0.959 . . . . 0.0 110.197 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.4 p . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 110.178 179.979 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.795 HD21 ' HB2' ' A' ' 27' ' ' ALA . 1.1 tp . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.304 0.573 . . . . 0.0 110.122 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 3.9 mtm -70.11 -43.42 71.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.193 -0.942 . . . . 0.0 110.152 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.44 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 0.1 OUTLIER -60.6 -35.56 76.42 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.286 -0.884 . . . . 0.0 110.129 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -73.51 -39.55 64.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.274 -0.891 . . . . 0.0 110.121 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.792 HG21 HD11 ' A' ' 80' ' ' LEU . 67.8 mt -64.79 -33.15 61.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 0.0 109.968 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.631 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -74.58 -48.64 25.51 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.213 -0.929 . . . . 0.0 108.956 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.402 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 6.3 m-20 -52.7 -23.03 5.89 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.785 HD22 ' HB2' ' A' ' 20' ' ' ALA . 9.9 mt -77.3 -39.57 47.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.831 -0.543 . . . . 0.0 109.942 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.537 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 81.0 p -48.79 -42.85 37.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.103 -0.998 . . . . 0.0 109.037 179.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.579 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 75.3 m-85 -45.05 -47.66 11.79 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.196 -0.94 . . . . 0.0 109.199 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.533 ' O ' ' C ' ' A' ' 50' ' ' VAL . 2.3 m-80 -66.88 89.83 0.17 Allowed 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.46 0.648 . . . . 0.0 110.421 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.533 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.19 -59.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.681 178.331 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.542 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.7 t -64.57 -65.09 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.157 -0.964 . . . . 0.0 110.424 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.622 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -36.52 -43.63 0.4 Allowed 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.149 0.5 . . . . 0.0 111.173 -177.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.623 ' HA ' HD12 ' A' ' 56' ' ' ILE . 6.5 t80 -58.99 -58.11 10.1 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.242 -0.911 . . . . 0.0 110.454 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.8 t -51.42 -36.0 41.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.258 -0.901 . . . . 0.0 110.46 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.9 -28.9 60.82 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.304 -0.873 . . . . 0.0 110.402 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.686 HD11 ' HB3' ' A' ' 46' ' ' LEU . 22.2 mt -73.03 -70.01 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -0.89 . . . . 0.0 110.472 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.54 ' HE1' ' CZ2' ' A' ' 61' ' ' TRP . 65.2 mmm -46.14 -36.35 5.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.096 -1.003 . . . . 0.0 110.021 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.5 m -53.83 -63.84 1.02 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.325 -0.86 . . . . 0.0 110.197 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -31.44 64.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.066 -1.021 . . . . 0.0 109.478 179.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.668 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.8 OUTLIER -63.15 -34.12 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.467 -0.771 . . . . 0.0 109.852 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.54 ' CZ2' ' HE1' ' A' ' 57' ' ' MET . 34.6 m95 -78.15 -29.33 48.65 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.186 -0.946 . . . . 0.0 110.186 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -58.74 7.09 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.243 -0.911 . . . . 0.0 110.197 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.484 ' HB3' ' HB3' ' A' ' 73' ' ' HIS . 2.8 mtt180 -71.04 -15.62 62.56 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.279 -0.888 . . . . 0.0 110.127 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.696 HD22 HD11 ' A' ' 106' ' ' LEU . 13.5 mt -80.73 -8.33 59.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.354 -0.841 . . . . 0.0 110.581 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.238 -0.914 . . . . 0.0 111.223 -179.321 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.524 ' CH2' ' HG2' ' A' ' 72' ' ' ARG . 44.0 p-90 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.245 0.545 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.524 ' HG2' ' CH2' ' A' ' 71' ' ' TRP . 38.7 mtt180 -49.24 -48.04 46.02 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.217 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 63' ' ' ARG . 30.1 m170 -54.19 -47.75 71.72 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.267 -0.896 . . . . 0.0 110.176 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.724 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 47.1 t -47.96 -50.4 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.257 -0.902 . . . . 0.0 110.206 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -52.6 -61.36 2.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.225 -0.922 . . . . 0.0 109.94 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.472 ' HE2' ' O ' ' A' ' 72' ' ' ARG . 8.5 mtmm -52.32 -23.17 5.4 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.239 -0.913 . . . . 0.0 109.476 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' A' ' 74' ' ' VAL . . . -70.91 -46.54 62.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.344 -0.848 . . . . 0.0 109.909 179.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.766 ' HE2' HG23 ' A' ' 123' ' ' VAL . 0.1 OUTLIER -53.19 -37.62 62.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.451 -0.781 . . . . 0.0 109.967 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.483 ' O ' ' HB3' ' A' ' 82' ' ' GLU . 1.9 m -62.86 -63.09 1.31 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.191 -0.943 . . . . 0.0 110.15 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.792 HD11 HG21 ' A' ' 43' ' ' ILE . 15.3 tp -44.86 -69.55 0.13 Allowed 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.199 -0.938 . . . . 0.0 109.39 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.551 ' HE2' HD11 ' A' ' 64' ' ' LEU . 6.5 ttp -39.09 -35.96 0.27 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.495 -0.753 . . . . 0.0 110.811 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.843 ' HB2' HD11 ' A' ' 130' ' ' LEU . 1.6 tm-20 -69.54 -66.16 0.62 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.011 -1.056 . . . . 0.0 110.247 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.559 ' CE1' HG21 ' A' ' 87' ' ' THR . 24.1 t80 -41.76 -48.81 4.32 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.237 -0.914 . . . . 0.0 110.841 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.746 HD11 HD11 ' A' ' 80' ' ' LEU . 7.5 mt -59.85 -48.48 81.52 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.084 -1.01 . . . . 0.0 110.278 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.664 HD12 HD21 ' A' ' 130' ' ' LEU . 76.0 mt -55.08 -23.37 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.189 -0.945 . . . . 0.0 110.008 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -87.73 -77.44 0.35 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.24 -0.912 . . . . 0.0 110.146 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.559 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.9 t -89.64 -20.56 23.54 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 110.258 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.631 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -43.74 -73.93 0.23 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.3 OUTLIER 172.32 175.09 0.09 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.194 -1.18 . . . . 0.0 110.223 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 25.8 mt-10 -73.65 -16.81 61.21 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.235 -0.916 . . . . 0.0 110.168 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -76.57 -35.09 58.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.252 -0.905 . . . . 0.0 110.05 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.555 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 69.9 t -63.06 -51.92 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.211 -0.931 . . . . 0.0 110.053 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 p -61.37 -43.2 99.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.199 -0.938 . . . . 0.0 109.993 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.466 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 6.4 mm-40 -53.18 -49.45 66.67 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.229 -0.919 . . . . 0.0 109.815 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.466 ' OE1' ' CB ' ' A' ' 57' ' ' MET . 5.2 tt0 -55.35 -44.01 75.57 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.489 -0.757 . . . . 0.0 109.62 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -43.21 62.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.336 -0.853 . . . . 0.0 109.432 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -66.73 -35.36 79.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.752 . . . . 0.0 109.829 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 19.7 mt-10 -78.62 -11.06 59.95 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.362 -0.836 . . . . 0.0 109.887 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -136.21 38.45 2.73 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.356 -0.84 . . . . 0.0 110.068 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 3.5 mtp -62.76 -33.29 74.85 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.286 -0.884 . . . . 0.0 110.221 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.459 ' O ' ' HB ' ' A' ' 105' ' ' THR . 4.2 m-30 -59.99 -21.12 60.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.322 -0.861 . . . . 0.0 110.039 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.9 ' O ' HG22 ' A' ' 105' ' ' THR . . . -81.87 -42.68 19.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.347 -0.845 . . . . 0.0 110.139 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.563 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.5 t -75.22 -19.59 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.38 -0.825 . . . . 0.0 109.927 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -91.89 -32.17 15.4 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.291 -0.881 . . . . 0.0 110.115 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.9 HG22 ' O ' ' A' ' 102' ' ' ALA . 14.7 t -58.15 -23.82 56.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.314 -0.866 . . . . 0.0 109.873 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.696 HD11 HD22 ' A' ' 64' ' ' LEU . 11.4 mt -69.19 -41.07 77.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.319 -0.863 . . . . 0.0 110.041 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 6.2 ttpp . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.337 -0.852 . . . . 0.0 110.258 179.959 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.558 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.5 p . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 121.4 0.619 . . . . 0.0 109.93 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.558 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.5 OUTLIER -45.18 -49.8 11.85 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.421 -0.799 . . . . 0.0 110.104 179.868 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.766 HG23 ' HE2' ' A' ' 78' ' ' MET . 7.1 p -59.49 -37.51 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 0.0 110.384 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.485 ' N ' HG13 ' A' ' 123' ' ' VAL . 14.8 mtm180 -62.75 -68.11 0.36 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.21 -0.931 . . . . 0.0 110.789 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 122' ' ' ASN . 0.0 OUTLIER -52.51 -33.26 44.26 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.311 -0.868 . . . . 0.0 110.96 -179.321 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 0.7 OUTLIER -59.56 -55.23 37.18 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.938 -1.101 . . . . 0.0 110.175 -179.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.563 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -53.89 -41.32 67.46 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.235 -0.915 . . . . 0.0 110.44 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.75 -35.66 75.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.247 -0.908 . . . . 0.0 110.421 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -66.72 -50.9 61.29 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.246 -0.909 . . . . 0.0 110.43 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.843 HD11 ' HB2' ' A' ' 82' ' ' GLU . 0.2 OUTLIER -54.11 -29.63 45.6 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.209 -0.932 . . . . 0.0 110.156 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 85.6 t -83.33 -29.6 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.307 -0.871 . . . . 0.0 110.224 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.4 -50.9 41.65 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.354 -0.842 . . . . 0.0 110.402 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.583 HD13 ' O ' ' A' ' 133' ' ' LEU . 0.8 OUTLIER -63.31 -51.44 66.0 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.211 -0.93 . . . . 0.0 110.382 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.704 HD13 ' O ' ' A' ' 130' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.178 -0.951 . . . . 0.0 110.301 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.228 0.537 . . . . 0.0 110.502 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.949 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -66.71 -48.59 68.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.096 -1.002 . . . . 0.0 110.236 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.452 ' HG3' HG13 ' A' ' 22' ' ' ILE . 24.4 pt-20 -43.55 -34.71 1.46 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.105 -0.997 . . . . 0.0 110.153 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.452 HG13 ' HG3' ' A' ' 21' ' ' GLU . 67.4 mt -74.53 -41.19 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.27 -0.894 . . . . 0.0 110.108 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -59.79 -46.5 88.99 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.225 -0.922 . . . . 0.0 110.193 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.919 HG22 HD21 ' A' ' 80' ' ' LEU . 16.8 t -60.27 -35.92 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.232 -0.917 . . . . 0.0 110.1 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -35.69 80.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.232 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -77.17 -34.8 56.33 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.238 -0.914 . . . . 0.0 110.085 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.7 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -63.66 -24.13 67.66 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.29 -0.881 . . . . 0.0 110.119 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.518 HG22 ' O ' ' A' ' 76' ' ' LYS . 56.2 p . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.222 -0.923 . . . . 0.0 110.088 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.7 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.14 0.495 . . . . 0.0 110.255 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 16.6 mtt -62.23 -62.16 1.96 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.271 -0.893 . . . . 0.0 110.242 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.439 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 50.0 m -53.97 -18.53 3.59 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.317 -0.865 . . . . 0.0 110.322 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -57.75 3.59 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 0.0 110.423 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.873 HG21 HD11 ' A' ' 80' ' ' LEU . 4.1 mt -48.34 -30.68 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.144 -0.973 . . . . 0.0 110.143 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.524 ' HA ' HD22 ' A' ' 84' ' ' LEU . . . -71.28 -56.04 6.82 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.095 -1.003 . . . . 0.0 109.558 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.462 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 12.1 t0 -49.98 -24.37 2.55 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.944 -1.098 . . . . 0.0 108.83 179.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.949 HD22 ' HB2' ' A' ' 20' ' ' ALA . 2.5 mt -74.04 -43.01 59.4 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.623 -0.673 . . . . 0.0 109.965 179.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.548 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 70.7 p -48.49 -42.97 34.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.163 -0.961 . . . . 0.0 109.324 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.568 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 79.8 m-85 -46.2 -47.48 17.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.261 -0.9 . . . . 0.0 109.237 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.549 ' O ' ' C ' ' A' ' 50' ' ' VAL . 1.1 t30 -68.74 91.34 0.44 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.549 -0.72 . . . . 0.0 110.434 179.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.549 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.65 -59.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.159 177.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.533 ' H ' HG13 ' A' ' 50' ' ' VAL . 2.6 t -62.65 -64.39 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.033 -1.042 . . . . 0.0 110.076 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.817 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -36.18 -48.09 0.6 Allowed 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.891 -177.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.548 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 13.9 t80 -57.67 -54.17 49.87 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.278 -0.889 . . . . 0.0 110.069 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.8 t -54.5 -24.6 21.2 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.298 -0.876 . . . . 0.0 110.042 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 51' ' ' VAL . 14.4 mm-40 -86.14 -28.02 24.24 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.283 -0.886 . . . . 0.0 109.973 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.858 HD11 ' HB3' ' A' ' 46' ' ' LEU . 6.4 mt -80.67 -70.31 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.345 -0.847 . . . . 0.0 110.147 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.445 ' HG2' ' HG2' ' A' ' 95' ' ' GLN . 0.9 OUTLIER -46.22 -39.42 9.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.322 -0.861 . . . . 0.0 110.031 179.766 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.4 m -56.44 -58.83 6.34 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.288 -0.882 . . . . 0.0 110.062 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 18.9 mmt -63.01 -15.93 58.08 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.253 -0.905 . . . . 0.0 109.968 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.787 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -81.31 -31.4 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 109.653 179.751 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.597 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 11.1 m95 -75.07 -46.13 36.84 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.287 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.47 ' HA ' ' OD1' ' A' ' 65' ' ' ASN . 11.4 mtpt -59.56 -53.18 61.01 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.278 -0.889 . . . . 0.0 109.981 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 85.8 mmt-85 -65.81 -9.63 30.36 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -0.884 . . . . 0.0 109.954 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.799 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 7.0 mt -88.53 -20.63 24.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.35 -0.844 . . . . 0.0 110.44 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.505 ' ND2' ' O ' ' A' ' 65' ' ' ASN . 2.4 p-10 . . . . . 0 C--N 1.302 -1.473 0 O-C-N 121.202 -0.936 . . . . 0.0 110.351 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.422 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 65.6 p-90 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.193 0.52 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.36 -38.02 18.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.235 -0.916 . . . . 0.0 109.935 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.405 ' ND1' ' N ' ' A' ' 73' ' ' HIS . 2.5 m-70 -61.8 -41.33 97.61 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.353 -0.842 . . . . 0.0 109.861 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.599 HG12 HG22 ' A' ' 123' ' ' VAL . 28.7 t -58.08 -52.34 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.481 -0.762 . . . . 0.0 110.076 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.448 ' HB2' HG23 ' A' ' 123' ' ' VAL . 8.5 t80 -49.92 -53.18 27.68 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.335 -0.853 . . . . 0.0 110.15 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.518 ' O ' HG22 ' A' ' 28' ' ' THR . 4.9 mmtt -64.03 -25.55 68.17 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.246 -0.909 . . . . 0.0 110.107 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.799 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -73.38 -23.83 60.23 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.262 -0.899 . . . . 0.0 110.026 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.599 ' SD ' HD13 ' A' ' 106' ' ' LEU . 0.7 OUTLIER -77.12 -41.42 42.03 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.232 -0.917 . . . . 0.0 109.815 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.5 m -58.03 -55.7 31.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.463 -0.773 . . . . 0.0 110.062 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.919 HD21 HG22 ' A' ' 24' ' ' VAL . 31.8 tp -50.84 -57.63 7.98 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.367 -0.833 . . . . 0.0 109.784 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.597 ' HE1' ' CZ3' ' A' ' 61' ' ' TRP . 1.8 ttp -47.29 -32.57 4.8 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.244 -0.91 . . . . 0.0 110.225 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.419 ' O ' ' C ' ' A' ' 83' ' ' TYR . 0.8 OUTLIER -75.17 -68.21 0.58 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.192 -0.943 . . . . 0.0 110.589 -179.908 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.465 ' O ' HG22 ' A' ' 87' ' ' THR . 48.7 t80 -40.33 -37.25 0.64 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 111.027 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.544 ' C ' HG11 ' A' ' 92' ' ' VAL . 52.7 mt -76.09 -40.18 53.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.175 -0.953 . . . . 0.0 110.548 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.884 HG21 HD11 ' A' ' 134' ' ' LEU . 20.4 mt -53.47 -27.41 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 120.974 -1.079 . . . . 0.0 110.186 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.82 -74.78 0.49 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.121 -0.987 . . . . 0.0 110.422 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.496 HG23 ' HB1' ' A' ' 44' ' ' ALA . 11.2 t -86.06 -22.31 27.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.251 -0.905 . . . . 0.0 110.336 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.568 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -43.87 -74.06 0.22 Allowed Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 3.1 t 172.25 160.75 0.11 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.151 -1.205 . . . . 0.0 110.293 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.07 -19.5 32.26 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.27 -0.894 . . . . 0.0 110.087 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -76.52 -38.12 55.65 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.273 -0.892 . . . . 0.0 110.187 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.544 HG11 ' C ' ' A' ' 84' ' ' LEU . 71.6 t -60.01 -28.07 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.291 -0.881 . . . . 0.0 110.084 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.4 p -86.06 -38.54 17.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.234 -0.916 . . . . 0.0 110.162 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -58.84 -57.49 12.8 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.292 -0.88 . . . . 0.0 109.98 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.445 ' HG2' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -52.75 -35.74 56.72 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.4 -0.813 . . . . 0.0 109.875 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.495 ' O ' ' N ' ' A' ' 100' ' ' MET . 0.7 OUTLIER -59.55 -43.42 93.54 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.328 -0.858 . . . . 0.0 109.778 179.587 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -66.6 -35.93 81.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.322 179.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -80.84 -10.05 59.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.498 -0.752 . . . . 0.0 109.721 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -135.64 26.87 3.38 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.43 -0.794 . . . . 0.0 109.848 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . 0.495 ' N ' ' O ' ' A' ' 96' ' ' CYS . 0.2 OUTLIER -61.53 -29.83 70.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.354 -0.841 . . . . 0.0 109.917 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -57.82 -27.31 63.03 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.329 -0.857 . . . . 0.0 109.816 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.774 ' O ' HG22 ' A' ' 105' ' ' THR . . . -72.13 -41.52 67.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.41 -0.806 . . . . 0.0 110.043 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.463 ' CG1' HG23 ' A' ' 131' ' ' VAL . 3.3 t -76.9 -19.92 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.364 -0.835 . . . . 0.0 109.946 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.612 ' HG2' HG21 ' A' ' 131' ' ' VAL . 1.1 mt-30 -91.28 -23.75 20.06 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.276 -0.89 . . . . 0.0 110.124 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.774 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.7 t -75.85 -24.31 55.76 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.252 -0.905 . . . . 0.0 110.098 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.754 HD11 HD22 ' A' ' 64' ' ' LEU . 10.0 mt -61.05 -42.67 98.92 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.262 -0.899 . . . . 0.0 109.967 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.513 ' HA ' ' CA ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.198 -0.939 . . . . 0.0 110.014 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.594 HG12 ' N ' ' A' ' 122' ' ' ASN . 6.6 t . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 121.054 0.454 . . . . 0.0 111.031 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.594 ' N ' HG12 ' A' ' 121' ' ' VAL . 16.2 m-80 -33.63 -33.54 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.766 -0.583 . . . . 0.0 111.197 -178.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.599 HG22 HG12 ' A' ' 74' ' ' VAL . 1.7 t -77.58 -49.2 22.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.916 -1.115 . . . . 0.0 109.703 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.513 ' CA ' ' HA ' ' A' ' 107' ' ' LYS . 10.9 mtm-85 -60.79 -56.6 19.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.109 -0.995 . . . . 0.0 110.732 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -62.1 -51.11 69.22 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.271 -0.893 . . . . 0.0 110.956 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 122' ' ' ASN . 0.6 OUTLIER -50.43 -48.32 56.31 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.012 -1.055 . . . . 0.0 110.255 -179.688 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -55.19 -46.04 75.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.36 -0.838 . . . . 0.0 110.591 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -62.12 -35.48 78.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.115 -0.991 . . . . 0.0 110.414 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -60.36 -51.48 69.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -0.913 . . . . 0.0 110.555 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.76 HD21 ' CD1' ' A' ' 85' ' ' ILE . 2.1 tt -53.9 -36.76 63.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.14 -0.975 . . . . 0.0 110.295 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.612 HG21 ' HG2' ' A' ' 104' ' ' GLN . 76.5 t -74.87 -27.1 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.353 -0.842 . . . . 0.0 110.144 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -68.42 -51.5 43.16 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.374 -0.829 . . . . 0.0 110.576 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.58 HD11 HD12 ' A' ' 134' ' ' LEU . 2.2 pp -63.83 -26.04 68.44 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.202 -0.936 . . . . 0.0 110.384 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.884 HD11 HG21 ' A' ' 85' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.666 0 O-C-N 121.268 -0.895 . . . . 0.0 110.106 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.227 0.537 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.76 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -67.85 -50.14 58.26 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.184 -0.947 . . . . 0.0 110.141 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HG3' HG13 ' A' ' 22' ' ' ILE . 16.7 pt-20 -49.21 -29.68 5.97 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.22 -0.925 . . . . 0.0 110.205 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.465 HG13 ' HG3' ' A' ' 21' ' ' GLU . 55.8 mt -74.71 -39.89 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.206 -0.934 . . . . 0.0 110.011 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.675 ' O ' HD11 ' A' ' 43' ' ' ILE . 14.7 mttp -70.66 -23.99 62.61 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.383 -0.823 . . . . 0.0 110.073 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.744 HG21 ' HA ' ' A' ' 56' ' ' ILE . 72.3 t -79.55 -34.1 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.249 -0.907 . . . . 0.0 110.152 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -40.38 87.73 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.296 -0.877 . . . . 0.0 110.263 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -44.12 54.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.335 -0.853 . . . . 0.0 110.176 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.631 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -57.06 -20.55 25.59 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.242 -0.911 . . . . 0.0 110.114 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.546 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 2.5 p . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.214 -0.929 . . . . 0.0 110.077 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.631 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 13.1 tp . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.266 0.555 . . . . 0.0 110.333 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.09 -42.61 99.65 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.15 -0.969 . . . . 0.0 110.316 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.422 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.3 OUTLIER -61.53 -33.46 73.86 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.118 -0.989 . . . . 0.0 110.193 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.08 -44.23 60.79 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.195 -0.94 . . . . 0.0 110.0 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.726 HG21 HD11 ' A' ' 80' ' ' LEU . 85.4 mt -59.64 -31.34 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.192 -0.942 . . . . 0.0 110.021 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.731 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -72.58 -52.79 14.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.924 . . . . 0.0 109.522 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.465 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 27.9 t0 -51.52 -22.39 3.14 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.988 -1.07 . . . . 0.0 108.679 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.76 HD13 ' CB ' ' A' ' 20' ' ' ALA . 15.1 mt -77.68 -40.64 40.8 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.593 -0.692 . . . . 0.0 109.908 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.52 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 68.0 p -49.64 -42.95 46.4 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.154 -0.967 . . . . 0.0 109.407 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.545 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 85.3 m-85 -44.88 -45.37 10.25 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.241 -0.912 . . . . 0.0 109.486 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.534 ' O ' ' N ' ' A' ' 51' ' ' VAL . 3.4 t-20 -71.47 92.65 1.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.511 -0.743 . . . . 0.0 110.331 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.523 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.75 -56.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.863 178.301 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.54 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.8 t -64.21 -65.7 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 120.954 -1.091 . . . . 0.0 110.495 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.684 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.51 -45.01 0.7 Allowed 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 121.169 0.509 . . . . 0.0 110.972 -177.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.585 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 16.7 t80 -60.19 -53.82 53.14 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.32 -0.862 . . . . 0.0 110.425 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' A' ' 58' ' ' SER . 9.2 t -56.62 -21.07 24.46 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.221 -0.924 . . . . 0.0 110.152 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -93.75 -22.46 18.69 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -0.894 . . . . 0.0 110.368 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.744 ' HA ' HG21 ' A' ' 24' ' ' VAL . 30.1 mt -81.67 -55.95 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.242 -0.911 . . . . 0.0 110.203 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.602 ' HE2' ' HG2' ' A' ' 95' ' ' GLN . 90.8 mmm -58.6 -36.12 73.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.196 -0.94 . . . . 0.0 109.705 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' ' 54' ' ' SER . 0.3 OUTLIER -59.02 -55.3 36.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.332 -0.855 . . . . 0.0 109.801 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.554 ' HB2' HG11 ' A' ' 24' ' ' VAL . 3.0 mmt -63.29 -25.08 68.15 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.225 -0.922 . . . . 0.0 109.766 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.685 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -73.67 -31.0 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.519 -0.738 . . . . 0.0 109.824 179.817 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.508 ' CZ2' ' HE1' ' A' ' 81' ' ' MET . 16.4 m95 -76.39 -56.99 4.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.127 -0.983 . . . . 0.0 110.143 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.13 -50.84 10.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.247 -0.908 . . . . 0.0 110.214 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -68.38 -31.87 71.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.212 -0.93 . . . . 0.0 110.151 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.793 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 7.4 mt -65.25 -26.82 68.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.29 -0.882 . . . . 0.0 110.054 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.302 -1.457 0 O-C-N 121.338 -0.851 . . . . 0.0 109.933 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.408 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 51.2 p-90 . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.269 0.557 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.54 -37.74 58.29 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.264 -0.897 . . . . 0.0 110.215 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -68.04 -32.03 72.11 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.303 -0.873 . . . . 0.0 110.204 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.677 HG12 ' HE2' ' A' ' 78' ' ' MET . 27.1 t -64.71 -59.4 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.196 -0.94 . . . . 0.0 110.2 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -47.02 -53.42 12.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.266 -0.896 . . . . 0.0 109.936 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.546 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -59.27 -33.07 70.61 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.239 -0.913 . . . . 0.0 109.63 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.793 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -66.71 -28.85 68.76 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.287 -0.883 . . . . 0.0 109.645 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.677 ' HE2' HG12 ' A' ' 74' ' ' VAL . 1.8 mtt -71.0 -32.92 69.86 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.282 -0.886 . . . . 0.0 109.923 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.0 m -67.87 -37.1 81.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.326 -0.859 . . . . 0.0 110.307 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.726 HD11 HG21 ' A' ' 43' ' ' ILE . 23.1 tp -73.06 -37.85 66.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.213 -0.929 . . . . 0.0 110.022 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.613 ' HG2' HD21 ' A' ' 130' ' ' LEU . 3.2 ttt -73.61 -27.0 61.06 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.173 -0.955 . . . . 0.0 109.946 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.5 ' HG3' HD12 ' A' ' 130' ' ' LEU . 1.8 tt0 -80.05 -37.67 33.5 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 110.015 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.422 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 37.1 t80 -72.7 -46.06 55.64 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.386 -0.821 . . . . 0.0 110.349 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.731 HD23 ' HB2' ' A' ' 44' ' ' ALA . 76.3 mt -66.63 -43.54 84.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.266 -0.896 . . . . 0.0 110.34 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.66 HD13 HD11 ' A' ' 134' ' ' LEU . 8.6 mt -53.41 -19.32 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.107 -0.996 . . . . 0.0 109.681 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -96.22 -79.32 0.45 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.272 -0.893 . . . . 0.0 110.18 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 88' ' ' GLY . 10.2 t -80.08 -23.63 41.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.221 -0.924 . . . . 0.0 110.288 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.56 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -43.97 -71.11 0.48 Allowed Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.466 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.6 OUTLIER 171.78 160.59 0.1 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.203 -1.175 . . . . 0.0 110.174 179.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -59.61 -16.17 23.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.219 -0.925 . . . . 0.0 110.093 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.0 mmt180 -79.79 -40.97 27.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.281 -0.887 . . . . 0.0 110.323 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.458 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 53.1 t -57.91 -38.17 64.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.151 -0.968 . . . . 0.0 109.933 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.2 m -71.49 -42.69 67.73 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.177 -0.952 . . . . 0.0 109.779 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -56.13 -39.73 72.7 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.287 -0.883 . . . . 0.0 109.777 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.602 ' HG2' ' HE2' ' A' ' 57' ' ' MET . 3.9 tt0 -68.64 -38.02 80.17 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.376 -0.827 . . . . 0.0 109.296 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.681 ' SG ' HD22 ' A' ' 134' ' ' LEU . 51.8 t -58.1 -28.62 64.78 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.028 -1.045 . . . . 0.0 108.807 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -87.2 -20.99 26.15 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.519 -0.738 . . . . 0.0 110.04 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.1 pt-20 -84.52 -20.01 32.3 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.104 -0.998 . . . . 0.0 109.932 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -124.7 44.49 2.76 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.394 -0.816 . . . . 0.0 110.099 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.12 -34.73 76.9 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.247 -0.908 . . . . 0.0 110.106 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -59.94 -21.44 61.17 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.362 -0.836 . . . . 0.0 110.01 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.756 ' O ' HG22 ' A' ' 105' ' ' THR . . . -82.46 -42.39 18.57 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.327 -0.858 . . . . 0.0 110.292 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.555 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.6 t -75.06 -18.82 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.325 -0.859 . . . . 0.0 110.268 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.501 ' HG2' HG21 ' A' ' 131' ' ' VAL . 6.8 mm-40 -95.33 -27.77 15.3 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.212 -0.93 . . . . 0.0 110.649 -179.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.756 HG22 ' O ' ' A' ' 102' ' ' ALA . 9.7 t -64.95 -14.67 60.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.089 -1.007 . . . . 0.0 110.094 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.723 HD11 HD22 ' A' ' 64' ' ' LEU . 8.9 mt -65.26 -34.23 77.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.356 -0.84 . . . . 0.0 110.197 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.343 -0.848 . . . . 0.0 110.428 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.546 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.443 0.64 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.546 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.6 OUTLIER -49.08 -50.96 34.32 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.488 -0.758 . . . . 0.0 110.007 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.598 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 6.4 p -74.24 -20.61 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.072 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.457 ' HB3' ' O ' ' A' ' 121' ' ' VAL . 9.9 ttt180 -68.29 -65.29 0.72 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.153 -0.967 . . . . 0.0 110.392 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -62.07 -28.92 69.95 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.382 -0.824 . . . . 0.0 110.47 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -58.55 7.95 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.063 -1.023 . . . . 0.0 110.082 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -51.87 -40.27 60.35 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.202 -0.936 . . . . 0.0 110.0 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -63.36 -36.85 85.09 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.282 -0.886 . . . . 0.0 110.375 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.49 -49.81 73.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.253 -0.904 . . . . 0.0 110.404 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.613 HD21 ' HG2' ' A' ' 81' ' ' MET . 0.9 OUTLIER -56.98 -28.84 62.73 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.963 -1.086 . . . . 0.0 109.654 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.501 HG21 ' HG2' ' A' ' 104' ' ' GLN . 55.7 t -78.53 -27.78 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.282 -0.886 . . . . 0.0 109.728 179.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -75.61 -57.41 3.9 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.378 -0.826 . . . . 0.0 110.374 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.95 -34.85 4.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.218 -0.926 . . . . 0.0 110.446 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.681 HD22 ' SG ' ' A' ' 96' ' ' CYS . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 O-C-N 121.134 -0.979 . . . . 0.0 110.394 -179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.16 0.505 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.617 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -58.42 -50.34 74.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.152 -0.968 . . . . 0.0 110.133 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' A' ' 20' ' ' ALA . 8.0 pt-20 -43.23 -29.64 0.41 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.27 -0.893 . . . . 0.0 110.08 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.7 mt -82.59 -43.13 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.238 -0.914 . . . . 0.0 110.073 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.624 ' O ' HD11 ' A' ' 43' ' ' ILE . 8.0 mmtm -57.11 -32.34 66.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.311 -0.868 . . . . 0.0 110.111 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.965 HG13 ' CD2' ' A' ' 80' ' ' LEU . 87.0 t -76.34 -43.6 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.986 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.18 -39.22 74.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.316 -0.865 . . . . 0.0 110.126 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -83.18 -29.48 28.53 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.393 -0.817 . . . . 0.0 110.154 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.893 ' HB2' HD12 ' A' ' 39' ' ' LEU . . . -62.14 -25.05 67.52 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.299 -0.876 . . . . 0.0 110.014 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.501 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 28.3 p . . . . . 0 N--CA 1.489 1.508 0 O-C-N 121.259 -0.901 . . . . 0.0 110.111 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.893 HD12 ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.206 0.527 . . . . 0.0 110.318 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.2 mmm -75.84 -60.67 2.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.235 -0.916 . . . . 0.0 110.464 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 86.0 p -48.93 -29.33 4.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.167 -0.958 . . . . 0.0 110.366 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -74.36 -53.5 9.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.264 -0.897 . . . . 0.0 110.403 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.843 HG21 HD11 ' A' ' 80' ' ' LEU . 44.4 mt -53.52 -39.62 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -0.925 . . . . 0.0 110.112 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.702 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -66.36 -51.08 60.78 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.076 -1.015 . . . . 0.0 109.168 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.48 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -56.22 -19.33 13.37 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.088 -1.008 . . . . 0.0 108.862 178.874 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.705 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 13.5 mt -82.76 -38.53 23.08 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.572 -0.705 . . . . 0.0 110.092 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.591 HG21 HG21 ' A' ' 92' ' ' VAL . 61.7 p -51.75 -43.28 62.86 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.078 -1.014 . . . . 0.0 109.223 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.48 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 88.3 m-85 -43.18 -43.41 4.64 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.475 -0.765 . . . . 0.0 109.485 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.543 ' O ' ' N ' ' A' ' 51' ' ' VAL . 2.6 t-20 -73.17 93.44 1.84 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.558 -0.714 . . . . 0.0 110.328 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.519 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.95 -56.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.908 178.37 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.543 ' N ' ' O ' ' A' ' 49' ' ' ASN . 3.1 t -66.19 -66.29 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.044 -1.035 . . . . 0.0 110.701 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.705 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.64 -46.09 0.84 Allowed 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.022 -177.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.532 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 3.1 t80 -56.44 -53.91 51.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.29 -0.881 . . . . 0.0 110.037 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.2 m -57.18 -21.83 36.09 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.144 -0.973 . . . . 0.0 110.025 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -88.95 -24.64 22.38 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.357 -0.839 . . . . 0.0 110.189 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.758 HG12 HG23 ' A' ' 43' ' ' ILE . 4.1 mt -79.15 -70.32 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.405 -0.809 . . . . 0.0 110.229 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.456 ' N ' HG22 ' A' ' 56' ' ' ILE . 5.0 mtp -46.17 -38.33 8.15 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.221 -0.925 . . . . 0.0 109.772 179.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -54.69 -62.08 1.89 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.358 -0.838 . . . . 0.0 110.048 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -23.11 58.86 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.969 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.769 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -73.95 -31.75 31.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.295 -0.878 . . . . 0.0 109.834 179.718 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.79 ' CZ2' ' HE1' ' A' ' 81' ' ' MET . 14.0 m95 -76.29 -63.44 1.33 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.138 -0.976 . . . . 0.0 110.265 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -44.83 -45.43 10.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.297 -0.877 . . . . 0.0 110.405 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -69.69 -34.15 73.52 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.286 -0.884 . . . . 0.0 110.386 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.979 HD22 HD11 ' A' ' 106' ' ' LEU . 7.5 mt -57.51 -20.52 31.99 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.221 -0.925 . . . . 0.0 110.42 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.4 m120 . . . . . 0 C--N 1.303 -1.428 0 O-C-N 121.252 -0.905 . . . . 0.0 110.136 -179.712 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 47.7 p-90 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.237 0.541 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.76 -28.52 22.68 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.262 -0.899 . . . . 0.0 110.018 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.1 -35.12 49.65 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.269 -0.894 . . . . 0.0 110.021 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.776 HG22 ' O ' ' A' ' 64' ' ' LEU . 13.3 t -60.65 -55.31 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.338 -0.851 . . . . 0.0 109.758 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -52.48 -52.85 52.26 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.35 -0.844 . . . . 0.0 109.874 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.501 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -61.13 -24.84 66.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.314 -0.866 . . . . 0.0 109.991 179.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.765 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -74.64 -34.02 62.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.309 -0.869 . . . . 0.0 109.997 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.624 ' SD ' ' HB2' ' A' ' 127' ' ' ALA . 0.0 OUTLIER -66.87 -30.87 71.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.371 -0.831 . . . . 0.0 109.462 179.513 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.2 m -66.73 -64.05 0.94 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.499 -0.75 . . . . 0.0 109.946 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.965 ' CD2' HG13 ' A' ' 24' ' ' VAL . 29.9 tp -46.87 -46.81 21.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.322 -0.861 . . . . 0.0 110.135 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 1.012 ' HG2' HD21 ' A' ' 130' ' ' LEU . 19.6 ttm -56.53 -42.99 79.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.114 -0.991 . . . . 0.0 110.205 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.718 ' HA ' HD12 ' A' ' 85' ' ' ILE . 62.6 tt0 -68.49 -65.91 0.64 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.243 -0.91 . . . . 0.0 110.336 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.582 ' O ' HG22 ' A' ' 87' ' ' THR . 57.9 t80 -37.52 -47.78 0.94 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.454 -0.779 . . . . 0.0 110.791 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.702 HD23 ' HB2' ' A' ' 44' ' ' ALA . 68.4 mt -68.03 -43.93 77.64 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.842 . . . . 0.0 110.222 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.001 HD13 HD11 ' A' ' 134' ' ' LEU . 23.5 mt -47.9 -29.54 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.033 -1.042 . . . . 0.0 109.75 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.63 -72.6 0.61 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.326 -0.859 . . . . 0.0 110.111 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.582 HG22 ' O ' ' A' ' 83' ' ' TYR . 8.0 t -83.8 -27.44 28.8 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.278 -0.889 . . . . 0.0 110.108 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.558 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -44.16 -85.83 0.01 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.466 ' O ' ' HB ' ' A' ' 92' ' ' VAL . 1.3 t -175.78 154.44 1.54 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -1.184 . . . . 0.0 110.382 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -47.68 -44.98 27.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.247 -0.908 . . . . 0.0 110.615 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -59.47 -43.43 93.24 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.42 -0.8 . . . . 0.0 110.199 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.625 HG11 ' CB ' ' A' ' 84' ' ' LEU . 18.9 t -53.12 -25.55 9.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.483 0 O-C-N 121.318 -0.864 . . . . 0.0 109.85 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.0 t -91.2 -35.13 14.7 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 110.059 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -61.61 -53.01 61.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.294 -0.878 . . . . 0.0 110.018 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 11.2 tt0 -60.22 -38.52 83.63 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.332 -0.855 . . . . 0.0 109.254 179.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.651 ' SG ' HD11 ' A' ' 85' ' ' ILE . 0.1 OUTLIER -55.77 -30.19 60.88 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.104 -0.998 . . . . 0.0 109.016 179.144 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.53 -23.55 27.66 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.447 -0.783 . . . . 0.0 110.254 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 4.8 pt-20 -80.42 -21.5 42.14 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.189 -0.944 . . . . 0.0 109.635 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.54 41.13 2.9 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.494 -0.754 . . . . 0.0 109.836 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . 0.431 ' HG3' ' N ' ' A' ' 101' ' ' TYR . 0.4 OUTLIER -61.04 -24.85 66.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.353 -0.842 . . . . 0.0 110.255 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.471 ' O ' ' HB ' ' A' ' 105' ' ' THR . 20.6 m-85 -68.67 -27.87 66.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.0 109.673 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 1.011 ' O ' HG22 ' A' ' 105' ' ' THR . . . -75.64 -43.62 46.85 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.439 -0.788 . . . . 0.0 110.062 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.607 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.9 t -71.36 -29.03 33.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.413 -0.804 . . . . 0.0 110.042 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.48 ' HG2' HG21 ' A' ' 131' ' ' VAL . 0.3 OUTLIER -83.56 -28.59 28.47 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.215 -0.928 . . . . 0.0 110.362 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 1.011 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.1 t -60.84 -23.51 65.16 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.193 -0.942 . . . . 0.0 110.108 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.979 HD11 HD22 ' A' ' 64' ' ' LEU . 19.0 mt -65.06 -41.95 94.66 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.233 -0.917 . . . . 0.0 109.936 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.492 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 31.2 ttpt . . . . . 0 N--CA 1.489 1.503 0 O-C-N 121.307 -0.871 . . . . 0.0 110.185 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.548 HG12 ' N ' ' A' ' 122' ' ' ASN . 32.4 t . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.274 0.559 . . . . 0.0 111.422 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.548 ' N ' HG12 ' A' ' 121' ' ' VAL . 14.5 m120 -33.01 -55.62 0.39 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.733 -0.604 . . . . 0.0 111.414 -178.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.601 ' CG2' HG12 ' A' ' 74' ' ' VAL . 9.9 p -66.69 -39.7 84.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 120.852 -1.155 . . . . 0.0 109.904 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.513 ' N ' HG13 ' A' ' 123' ' ' VAL . 8.9 ttp180 -62.03 -70.9 0.17 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.167 -0.958 . . . . 0.0 110.634 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.403 ' N ' ' HG2' ' A' ' 124' ' ' ARG . 21.8 mt-10 -55.2 -28.67 54.68 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.241 -0.912 . . . . 0.0 110.656 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.498 ' CB ' ' O ' ' A' ' 122' ' ' ASN . 6.1 tptp -62.35 -62.4 1.78 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.092 -1.005 . . . . 0.0 109.578 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.624 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -47.7 -40.87 21.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.356 -0.84 . . . . 0.0 110.004 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.419 ' HG3' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -60.26 -40.31 89.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.215 -0.928 . . . . 0.0 110.381 -179.918 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -54.22 26.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.205 -0.934 . . . . 0.0 110.479 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 1.012 HD21 ' HG2' ' A' ' 81' ' ' MET . 11.7 tp -46.95 -28.98 1.81 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.171 -0.956 . . . . 0.0 109.929 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.48 HG21 ' HG2' ' A' ' 104' ' ' GLN . 28.8 t -79.98 -38.77 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.347 -0.846 . . . . 0.0 109.784 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.81 -47.94 81.16 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.327 -0.858 . . . . 0.0 110.249 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 24.9 tp -54.38 -47.79 72.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.287 -0.883 . . . . 0.0 110.399 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 1.001 HD11 HD13 ' A' ' 85' ' ' ILE . 9.3 mt . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.162 -0.961 . . . . 0.0 110.237 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.26 0.552 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.754 ' CA ' HD13 ' A' ' 46' ' ' LEU . . . -53.31 -49.0 67.94 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.275 -0.891 . . . . 0.0 110.117 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.44 ' CG ' ' N ' ' A' ' 22' ' ' ILE . 14.4 pt-20 -44.06 -37.58 3.1 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.992 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.44 ' N ' ' CG ' ' A' ' 21' ' ' GLU . 29.3 mm -72.07 -42.63 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.322 -0.861 . . . . 0.0 110.074 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.597 ' O ' HD11 ' A' ' 39' ' ' LEU . 29.0 mmtt -56.41 -32.75 65.14 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.178 -0.951 . . . . 0.0 110.226 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.566 HG21 ' HA ' ' A' ' 56' ' ' ILE . 90.1 t -76.75 -37.46 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.294 -0.879 . . . . 0.0 110.191 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.3 -37.89 75.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.171 -0.956 . . . . 0.0 110.24 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -82.83 -48.85 10.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.328 -0.857 . . . . 0.0 110.164 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 1.087 ' HB2' HD12 ' A' ' 39' ' ' LEU . . . -44.6 -47.78 10.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.9 . . . . 0.0 110.17 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.48 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 4.8 p . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.346 -0.846 . . . . 0.0 110.183 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 1.087 HD12 ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.271 0.558 . . . . 0.0 110.229 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -90.28 -59.38 2.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.281 -0.887 . . . . 0.0 110.203 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.07 -12.44 61.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.301 -0.874 . . . . 0.0 110.228 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -83.98 -66.01 0.94 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.292 -0.88 . . . . 0.0 110.336 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.598 HG21 HD11 ' A' ' 80' ' ' LEU . 79.8 mt -46.24 -38.1 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.217 -0.927 . . . . 0.0 110.094 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.752 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -68.11 -52.01 39.83 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.184 -0.948 . . . . 0.0 109.387 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.526 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 19.7 t0 -53.61 -20.84 5.68 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.064 -1.022 . . . . 0.0 108.912 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.754 HD13 ' CA ' ' A' ' 20' ' ' ALA . 13.4 mt -81.56 -36.41 29.11 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.578 -0.702 . . . . 0.0 110.06 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.528 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 73.1 p -52.19 -40.92 62.18 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.08 -1.013 . . . . 0.0 109.157 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.558 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 79.6 m-85 -43.22 -43.87 4.96 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 119.556 -0.857 . . . . 0.0 109.394 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 51' ' ' VAL . 1.2 t-20 -73.72 91.31 1.89 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.62 -0.675 . . . . 0.0 110.45 179.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -11.56 -56.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.696 178.183 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.548 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.7 t -63.97 -65.85 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 120.972 -1.08 . . . . 0.0 110.197 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -39.33 -41.96 0.98 Allowed 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 121.241 0.543 . . . . 0.0 110.633 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.577 ' CE1' ' HA ' ' A' ' 92' ' ' VAL . 4.2 t80 -62.1 -57.57 11.09 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.458 -0.776 . . . . 0.0 110.546 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 58' ' ' SER . 0.4 OUTLIER -55.17 -24.7 28.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.21 -0.931 . . . . 0.0 110.418 -179.458 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -87.87 -25.0 23.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.247 -0.908 . . . . 0.0 110.272 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.61 HD11 ' HB3' ' A' ' 46' ' ' LEU . 19.7 mt -74.75 -70.28 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.369 -0.832 . . . . 0.0 110.426 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.465 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 4.2 mtp -45.82 -37.94 6.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.22 -0.925 . . . . 0.0 110.097 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 54' ' ' SER . 0.4 OUTLIER -53.22 -59.02 5.09 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.191 -0.943 . . . . 0.0 109.861 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -27.74 67.83 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.181 -0.949 . . . . 0.0 109.585 179.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.881 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -68.82 -29.05 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.425 -0.797 . . . . 0.0 109.705 179.539 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.418 ' CD1' ' O ' ' A' ' 57' ' ' MET . 20.9 m95 -79.08 -37.18 39.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.189 -0.944 . . . . 0.0 110.229 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -62.86 -56.76 14.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.255 -0.903 . . . . 0.0 110.314 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.43 -26.26 68.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.212 -0.93 . . . . 0.0 110.252 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.811 HD11 ' CE ' ' A' ' 81' ' ' MET . 8.4 mt -64.51 -15.43 60.85 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.287 -0.883 . . . . 0.0 110.354 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.6 m120 . . . . . 0 C--N 1.302 -1.489 0 O-C-N 121.249 -0.907 . . . . 0.0 110.354 -179.394 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.485 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 26.0 p-90 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.293 0.568 . . . . 0.0 110.067 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.485 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 4.2 tpt180 -43.47 -43.4 5.35 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.27 -0.894 . . . . 0.0 110.097 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 39.3 m170 -56.86 -47.28 80.77 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.246 -0.909 . . . . 0.0 110.063 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.8 HG11 HD22 ' A' ' 106' ' ' LEU . 59.4 t -51.87 -49.57 36.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.287 -0.883 . . . . 0.0 109.925 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.508 ' CE1' ' HG2' ' A' ' 126' ' ' LYS . 10.0 t80 -51.41 -59.84 3.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.191 -0.943 . . . . 0.0 109.925 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.48 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 8.6 mmtt -52.1 -27.0 12.52 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.905 . . . . 0.0 109.779 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.676 ' HB3' ' O ' ' A' ' 74' ' ' VAL . . . -68.31 -54.36 17.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.376 -0.827 . . . . 0.0 110.232 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.762 ' HE1' HG12 ' A' ' 74' ' ' VAL . 2.3 mpp? -47.09 -38.13 10.82 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.382 -0.823 . . . . 0.0 110.34 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.6 m -67.18 -38.77 85.95 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.165 -0.959 . . . . 0.0 110.212 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.881 ' CD2' HD11 ' A' ' 60' ' ' ILE . 16.7 tp -65.85 -64.58 0.83 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.224 -0.922 . . . . 0.0 109.138 179.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.811 ' CE ' HD11 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -51.86 -27.15 11.72 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.268 -0.895 . . . . 0.0 110.331 179.536 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.652 ' HB2' HD22 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -75.84 -35.47 59.96 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.006 -1.059 . . . . 0.0 110.035 179.629 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.579 ' CE2' HG21 ' A' ' 87' ' ' THR . 33.8 t80 -75.81 -58.21 3.42 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.403 -0.811 . . . . 0.0 110.58 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.572 ' HB2' HG11 ' A' ' 92' ' ' VAL . 5.3 mt -46.72 -48.49 20.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.169 -0.957 . . . . 0.0 109.83 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.044 HD13 HD21 ' A' ' 134' ' ' LEU . 63.1 mt -48.23 -43.05 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.107 -0.996 . . . . 0.0 110.322 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.3 tttp -75.55 -78.0 0.12 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.251 -0.906 . . . . 0.0 110.717 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.579 HG21 ' CE2' ' A' ' 83' ' ' TYR . 7.8 t -86.01 -25.61 25.87 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.159 -0.963 . . . . 0.0 110.764 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.752 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -43.48 -80.13 0.05 OUTLIER Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.4 t -172.25 161.6 5.38 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.175 -1.191 . . . . 0.0 110.194 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.4 -27.04 68.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.206 -0.934 . . . . 0.0 110.186 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.431 ' HG3' ' CD2' ' A' ' 53' ' ' PHE . 9.9 ptp180 -72.75 -34.67 67.18 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.197 -0.939 . . . . 0.0 109.852 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.577 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 54.0 t -58.4 -51.63 69.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.284 -0.885 . . . . 0.0 109.942 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.3 t -58.46 -41.36 85.02 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.177 -0.952 . . . . 0.0 109.71 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -57.95 -40.07 79.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.226 -0.921 . . . . 0.0 109.795 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.527 ' HA ' ' HG2' ' A' ' 98' ' ' GLU . 6.4 tp-100 -67.53 -39.37 85.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.315 -0.866 . . . . 0.0 109.397 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.62 ' SG ' HD11 ' A' ' 85' ' ' ILE . 2.7 t -56.59 -31.95 64.76 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.221 -0.924 . . . . 0.0 108.831 179.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.446 ' HA ' ' SD ' ' A' ' 100' ' ' MET . 0.8 OUTLIER -81.42 -24.92 36.58 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.512 -0.742 . . . . 0.0 109.771 179.333 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.527 ' HG2' ' HA ' ' A' ' 95' ' ' GLN . 0.1 OUTLIER -77.94 -22.84 48.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.245 -0.909 . . . . 0.0 109.743 179.736 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.502 ' N ' ' HG3' ' A' ' 98' ' ' GLU . 8.4 t30 -132.19 38.53 3.48 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.555 -0.716 . . . . 0.0 109.797 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . 0.446 ' SD ' ' HA ' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -60.53 -34.72 74.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.834 . . . . 0.0 109.908 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.456 ' O ' ' HB ' ' A' ' 105' ' ' THR . 66.3 m-85 -57.08 -27.96 62.18 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.301 -0.874 . . . . 0.0 109.688 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 1.005 ' O ' HG22 ' A' ' 105' ' ' THR . . . -71.93 -42.86 66.15 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.459 -0.775 . . . . 0.0 110.077 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.658 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 6.2 t -68.81 -28.16 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.702 ' HG2' HG21 ' A' ' 131' ' ' VAL . 1.2 mm100 -90.37 -20.66 22.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.915 . . . . 0.0 110.449 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 1.005 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.2 t -61.32 -22.44 64.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.198 -0.939 . . . . 0.0 110.24 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.8 HD22 HG11 ' A' ' 74' ' ' VAL . 35.3 mt -61.44 -39.12 89.65 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 110.204 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 124' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.209 -0.932 . . . . 0.0 110.146 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.552 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.391 0.615 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.552 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 2.6 m-80 -37.72 -28.31 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.816 -0.552 . . . . 0.0 110.804 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' A' ' 121' ' ' VAL . 3.8 t -81.72 -58.72 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.188 -0.945 . . . . 0.0 110.382 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.484 ' HB2' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -50.62 -30.96 14.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.222 -0.924 . . . . 0.0 110.799 -179.476 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.508 ' HG3' HG22 ' A' ' 121' ' ' VAL . 3.3 mt-10 -81.45 -53.76 6.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.221 -0.925 . . . . 0.0 111.169 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.508 ' HG2' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -51.64 -47.12 63.85 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.081 -1.012 . . . . 0.0 110.593 -179.465 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.658 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -67.65 -41.55 83.63 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.3 -0.875 . . . . 0.0 111.003 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 124' ' ' ARG . 0.2 OUTLIER -58.53 -43.84 89.37 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.074 -1.016 . . . . 0.0 110.884 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.452 ' OE1' ' N ' ' A' ' 129' ' ' GLN . 0.5 OUTLIER -64.94 -49.44 70.36 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.086 -1.009 . . . . 0.0 110.803 -179.519 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.652 HD22 ' HB2' ' A' ' 82' ' ' GLU . 12.1 tp -51.26 -41.69 60.55 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.062 -1.024 . . . . 0.0 110.258 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.702 HG21 ' HG2' ' A' ' 104' ' ' GLN . 25.3 t -66.3 -32.77 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.252 -0.905 . . . . 0.0 109.878 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.9 -51.71 56.32 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.145 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.43 ' O ' ' C ' ' A' ' 134' ' ' LEU . 0.5 OUTLIER -61.69 -42.07 98.43 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.323 -0.86 . . . . 0.0 110.446 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 1.044 HD21 HD13 ' A' ' 85' ' ' ILE . 1.5 mm? . . . . . 0 N--CA 1.491 1.621 0 O-C-N 121.309 -0.87 . . . . 0.0 110.299 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.242 0.544 . . . . 0.0 110.385 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.481 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -58.91 -47.22 85.78 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.297 -0.877 . . . . 0.0 110.182 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.425 ' HG3' HG12 ' A' ' 22' ' ' ILE . 10.4 pt-20 -45.22 -30.95 1.33 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.275 -0.891 . . . . 0.0 109.991 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.425 HG12 ' HG3' ' A' ' 21' ' ' GLU . 27.9 mm -75.5 -44.74 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.345 -0.847 . . . . 0.0 110.038 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.483 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 2.9 mmtp -55.53 -51.88 65.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.244 -0.91 . . . . 0.0 110.003 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.833 HG21 ' HA ' ' A' ' 56' ' ' ILE . 98.7 t -58.57 -37.63 66.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.224 -0.923 . . . . 0.0 110.064 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -69.05 0.13 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.253 -0.904 . . . . 0.0 109.977 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -64.08 -13.64 48.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.423 -0.798 . . . . 0.0 110.199 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.863 ' HB2' HD12 ' A' ' 39' ' ' LEU . . . -77.0 -30.3 55.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.249 -0.907 . . . . 0.0 110.082 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.492 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 32.7 p . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.304 -0.872 . . . . 0.0 110.031 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.863 HD12 ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.232 0.539 . . . . 0.0 110.247 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.35 -53.75 9.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.268 -0.895 . . . . 0.0 110.235 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.3 t -56.75 -27.46 59.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.198 -0.939 . . . . 0.0 110.207 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.16 -50.19 12.43 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.3 -0.875 . . . . 0.0 110.233 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.732 HG21 HD11 ' A' ' 80' ' ' LEU . 82.1 mt -56.31 -36.48 46.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.201 -0.937 . . . . 0.0 110.012 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.638 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -67.65 -49.85 60.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.303 -0.873 . . . . 0.0 109.654 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.482 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 25.8 t70 -55.31 -18.86 7.12 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.124 -0.985 . . . . 0.0 109.141 179.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.507 ' HB3' ' HB1' ' A' ' 52' ' ' ALA . 10.7 mt -85.32 -34.22 21.91 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.529 -0.732 . . . . 0.0 110.119 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.525 HG21 HG21 ' A' ' 92' ' ' VAL . 76.1 p -56.23 -41.08 75.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.153 -0.967 . . . . 0.0 109.521 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.582 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 85.4 m-85 -43.3 -43.69 5.06 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 119.776 -0.77 . . . . 0.0 109.195 179.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.479 ' HB2' ' O ' ' A' ' 46' ' ' LEU . 5.6 m-20 -58.87 -160.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.662 0.744 . . . . 0.0 110.051 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 m -122.01 -32.35 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.547 HG12 ' N ' ' A' ' 52' ' ' ALA . 10.6 t -85.64 -70.86 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 CA-C-O 121.947 0.88 . . . . 0.0 109.806 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.567 ' O ' HD12 ' A' ' 56' ' ' ILE . . . -38.31 -40.38 0.52 Allowed 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.787 -177.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.669 ' CE1' HG22 ' A' ' 92' ' ' VAL . 7.4 t80 -55.39 -58.86 6.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.257 -0.902 . . . . 0.0 110.291 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 58' ' ' SER . 67.3 m -55.62 -41.08 72.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.18 -0.95 . . . . 0.0 110.086 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.6 -25.08 67.24 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.359 -0.838 . . . . 0.0 109.971 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.833 ' HA ' HG21 ' A' ' 24' ' ' VAL . 10.8 mt -79.33 -70.4 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.404 -0.81 . . . . 0.0 110.144 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.445 ' HA ' ' HB ' ' A' ' 60' ' ' ILE . 15.3 mtp -47.96 -39.82 20.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.192 -0.943 . . . . 0.0 109.596 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.447 ' HB2' ' O ' ' A' ' 54' ' ' SER . 38.5 t -53.42 -57.29 11.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.325 -0.86 . . . . 0.0 109.762 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.445 ' HB2' HG11 ' A' ' 24' ' ' VAL . 8.8 mmt -62.17 -23.17 66.44 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.232 -0.918 . . . . 0.0 109.596 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.69 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -72.42 -31.74 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.405 -0.81 . . . . 0.0 109.29 179.524 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -74.7 -44.99 47.29 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.352 -0.842 . . . . 0.0 109.722 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.59 -52.93 61.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.254 -0.904 . . . . 0.0 109.705 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.52 ' HD3' ' CD2' ' A' ' 73' ' ' HIS . 14.5 mmp_? -62.7 -35.79 80.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.229 -0.92 . . . . 0.0 109.713 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 1.031 ' O ' HG22 ' A' ' 74' ' ' VAL . 4.1 mt -54.4 -24.02 18.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.351 -0.843 . . . . 0.0 110.052 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.7 t30 . . . . . 0 C--N 1.299 -1.615 0 O-C-N 121.469 -0.769 . . . . 0.0 109.141 179.915 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.519 ' CZ3' ' HB2' ' A' ' 122' ' ' ASN . 58.4 p-90 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 121.137 0.494 . . . . 0.0 110.468 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.0 mmt180 -71.44 -70.35 0.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.188 -0.945 . . . . 0.0 110.492 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.52 ' CD2' ' HD3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -55.98 -49.46 73.52 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.214 -0.929 . . . . 0.0 110.138 -179.851 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 1.031 HG22 ' O ' ' A' ' 64' ' ' LEU . 68.8 t -44.0 -53.01 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.434 -0.791 . . . . 0.0 110.488 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.511 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 5.3 t80 -49.68 -56.27 10.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.273 -0.892 . . . . 0.0 110.196 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.492 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -56.59 -28.53 60.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.201 -0.937 . . . . 0.0 110.144 179.945 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.886 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -71.14 -34.92 71.48 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.361 -0.837 . . . . 0.0 109.81 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.838 ' HE1' HG22 ' A' ' 123' ' ' VAL . 0.6 OUTLIER -61.8 -38.9 89.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.472 -0.768 . . . . 0.0 109.715 179.52 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 40.9 m -61.04 -63.91 1.13 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.278 -0.889 . . . . 0.0 110.058 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.749 HD21 HG22 ' A' ' 24' ' ' VAL . 20.1 tp -47.35 -54.1 12.03 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.212 -0.93 . . . . 0.0 110.068 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.873 ' HG2' HD22 ' A' ' 130' ' ' LEU . 3.7 ttp -50.76 -37.25 40.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.193 -0.942 . . . . 0.0 110.365 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.538 ' HA ' HD21 ' A' ' 130' ' ' LEU . 26.2 tt0 -74.17 -68.58 0.51 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.096 -1.003 . . . . 0.0 110.574 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.565 ' CE2' HG21 ' A' ' 87' ' ' THR . 55.0 t80 -37.58 -45.91 0.8 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.494 -0.754 . . . . 0.0 111.367 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.558 ' CB ' HG11 ' A' ' 92' ' ' VAL . 75.6 mt -66.68 -42.31 86.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.14 -0.975 . . . . 0.0 110.695 -179.243 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.909 HD13 HD11 ' A' ' 134' ' ' LEU . 32.3 mt -52.73 -19.91 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 120.933 -1.104 . . . . 0.0 110.158 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.82 -87.96 0.44 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.297 -0.877 . . . . 0.0 110.293 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.565 HG21 ' CE2' ' A' ' 83' ' ' TYR . 14.9 t -69.41 -6.21 28.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.224 -0.922 . . . . 0.0 110.222 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.638 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -72.19 -78.74 0.48 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.3 t -174.81 157.01 2.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.11 -1.229 . . . . 0.0 110.234 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.92 -21.84 65.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.302 -0.874 . . . . 0.0 110.191 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.28 -39.5 59.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.22 -0.925 . . . . 0.0 110.08 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.669 HG22 ' CE1' ' A' ' 53' ' ' PHE . 78.4 t -58.69 -31.48 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.289 -0.882 . . . . 0.0 110.074 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 29.6 p -79.06 -38.69 35.79 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.159 -0.963 . . . . 0.0 110.018 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -59.67 -59.37 5.55 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.283 -0.885 . . . . 0.0 109.832 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.42 -35.85 63.37 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.481 -0.762 . . . . 0.0 109.8 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.562 ' HB3' HD13 ' A' ' 134' ' ' LEU . 11.6 m -60.91 -36.38 79.12 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.19 -0.944 . . . . 0.0 109.713 179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -73.83 -26.63 60.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.403 -0.811 . . . . 0.0 109.589 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -81.85 -22.84 36.76 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.373 -0.829 . . . . 0.0 110.057 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -111.52 34.75 3.95 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.286 -0.884 . . . . 0.0 110.34 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.6 ptp -60.97 -31.06 70.65 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.215 -0.928 . . . . 0.0 110.17 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -61.42 -26.27 67.75 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.888 . . . . 0.0 110.2 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 1.022 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.65 -40.75 48.15 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.244 -0.91 . . . . 0.0 110.15 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.573 HG22 ' HE1' ' A' ' 81' ' ' MET . 5.3 t -72.12 -27.46 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.376 -0.828 . . . . 0.0 110.151 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.73 ' NE2' HG11 ' A' ' 131' ' ' VAL . 15.5 mm-40 -82.18 -26.89 32.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.174 -0.954 . . . . 0.0 110.315 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 1.022 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.1 t -64.85 -12.64 50.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.128 -0.983 . . . . 0.0 110.04 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 1.002 HD11 HD22 ' A' ' 64' ' ' LEU . 65.4 mt -77.23 -33.17 56.18 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.274 -0.891 . . . . 0.0 110.181 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.536 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 1.2 ttmt . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.378 -0.827 . . . . 0.0 110.464 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.542 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 2.8 p . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 121.277 0.561 . . . . 0.0 110.146 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.542 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.0 OUTLIER -36.13 -31.2 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.833 -0.542 . . . . 0.0 110.775 -179.669 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.838 HG22 ' HE1' ' A' ' 78' ' ' MET . 1.0 OUTLIER -82.19 -46.07 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.263 -0.898 . . . . 0.0 109.917 179.783 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.536 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -57.35 -30.88 65.2 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.203 -0.936 . . . . 0.0 110.61 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.457 ' OE1' HG13 ' A' ' 121' ' ' VAL . 44.8 mt-10 -82.71 -54.75 4.89 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.196 -0.94 . . . . 0.0 111.055 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.511 ' HG3' ' CE1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -52.62 -49.64 64.71 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.096 -1.002 . . . . 0.0 110.235 -179.631 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.523 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -61.14 -41.62 97.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.314 -0.866 . . . . 0.0 110.431 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 124' ' ' ARG . 2.4 ttmt -56.9 -49.66 74.91 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.161 -0.962 . . . . 0.0 110.369 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -55.2 -49.59 71.54 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 110.379 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.873 HD22 ' HG2' ' A' ' 81' ' ' MET . 0.3 OUTLIER -53.29 -40.82 65.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.161 -0.962 . . . . 0.0 110.161 -179.916 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.73 HG11 ' NE2' ' A' ' 104' ' ' GLN . 26.4 t -72.75 -25.91 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.356 -0.84 . . . . 0.0 110.191 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -70.23 -56.17 7.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.218 -0.926 . . . . 0.0 110.389 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 15.7 tp -69.9 -37.8 76.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.289 -0.882 . . . . 0.0 110.377 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.909 HD11 HD13 ' A' ' 85' ' ' ILE . 30.9 mt . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.154 -0.966 . . . . 0.0 110.206 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.21 0.528 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.953 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -65.01 -52.97 53.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.233 -0.917 . . . . 0.0 110.15 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.409 ' CG ' ' N ' ' A' ' 22' ' ' ILE . 12.5 pt-20 -50.1 -34.1 20.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.236 -0.915 . . . . 0.0 110.053 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.409 ' N ' ' CG ' ' A' ' 21' ' ' GLU . 13.4 mt -66.07 -39.41 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.255 -0.903 . . . . 0.0 109.934 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.457 ' CB ' HG12 ' A' ' 43' ' ' ILE . 1.6 mmtm -67.11 -39.55 86.69 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.296 -0.877 . . . . 0.0 110.017 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.768 HG13 HD23 ' A' ' 80' ' ' LEU . 56.1 t -57.83 -38.68 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.353 -0.842 . . . . 0.0 110.091 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.508 ' HD3' ' CZ ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -63.35 -50.68 69.01 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.281 -0.887 . . . . 0.0 110.157 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 49.1 tt0 -68.95 -17.05 63.89 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.432 -0.793 . . . . 0.0 109.959 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.737 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -79.78 -33.16 40.79 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.343 -0.848 . . . . 0.0 110.147 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.497 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 82.3 p . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.211 -0.93 . . . . 0.0 110.107 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.737 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.283 0.563 . . . . 0.0 110.22 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 5.4 mtt -67.48 -62.2 1.53 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.171 -0.955 . . . . 0.0 110.234 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.44 -24.2 7.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.263 -0.898 . . . . 0.0 110.267 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.83 -54.02 8.06 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.156 -0.965 . . . . 0.0 110.176 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.589 HD11 ' HB2' ' A' ' 27' ' ' ALA . 79.3 mt -52.96 -32.85 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.149 -0.969 . . . . 0.0 109.951 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.527 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.23 -52.91 19.54 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.182 -0.949 . . . . 0.0 109.62 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.598 ' HA ' ' CD1' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -51.55 -21.46 2.52 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.021 -1.049 . . . . 0.0 109.455 179.268 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.953 HD22 ' HB2' ' A' ' 20' ' ' ALA . 4.6 mt -76.92 -40.97 45.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.429 -0.794 . . . . 0.0 110.133 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.689 HG21 ' CG2' ' A' ' 92' ' ' VAL . 42.9 p -53.97 -43.07 69.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.257 -0.902 . . . . 0.0 109.712 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.598 ' CD1' ' HA ' ' A' ' 45' ' ' ASP . 81.6 m-85 -40.48 -38.96 0.92 Allowed 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 119.945 -0.702 . . . . 0.0 109.529 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.466 ' O ' ' O ' ' A' ' 48' ' ' TYR . 13.7 m120 -58.08 -152.71 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.69 0.757 . . . . 0.0 110.168 179.057 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.7 t -128.11 -15.89 2.68 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.275 -177.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.646 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 0.3 OUTLIER -110.14 -48.1 6.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 CA-C-O 122.42 1.105 . . . . 0.0 108.569 179.151 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.695 ' HB1' ' HB3' ' A' ' 46' ' ' LEU . . . -48.82 -47.27 42.54 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.37 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.548 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 2.1 t80 -56.88 -54.7 43.48 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.374 -0.829 . . . . 0.0 109.819 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.88 -21.62 61.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.276 -0.89 . . . . 0.0 110.325 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' A' ' 51' ' ' VAL . 2.8 mm-40 -90.72 -19.6 23.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.309 -0.87 . . . . 0.0 110.048 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.629 HG21 HD13 ' A' ' 84' ' ' LEU . 7.3 mt -80.77 -70.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.383 -0.823 . . . . 0.0 110.0 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.574 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 95.8 mmm -45.17 -35.57 3.31 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -56.9 -59.56 4.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.345 -0.847 . . . . 0.0 109.806 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.451 ' HB3' HG11 ' A' ' 24' ' ' VAL . 0.0 OUTLIER -59.08 -25.64 63.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.333 -0.854 . . . . 0.0 109.966 179.653 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.692 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -74.15 -29.97 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.364 -0.835 . . . . 0.0 109.936 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.574 ' CD1' ' O ' ' A' ' 57' ' ' MET . 18.2 m95 -76.07 -44.76 37.43 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.158 -0.964 . . . . 0.0 110.387 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -49.06 79.11 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.222 -0.924 . . . . 0.0 110.434 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.508 ' CZ ' ' HD3' ' A' ' 25' ' ' ARG . 12.5 mmt85 -70.6 -32.02 69.23 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.22 -0.925 . . . . 0.0 110.32 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.995 HD22 HD11 ' A' ' 106' ' ' LEU . 3.9 mt -57.0 -18.67 14.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.319 -0.863 . . . . 0.0 110.503 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.0 t30 . . . . . 0 C--N 1.301 -1.504 0 O-C-N 121.238 -0.914 . . . . 0.0 109.935 -179.953 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 47.4 p-90 . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.203 0.525 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 73' ' ' HIS . 1.3 ptp180 -55.56 -27.11 47.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.255 -0.903 . . . . 0.0 110.224 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.424 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -72.71 -36.14 67.74 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 109.986 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.705 HG12 ' HE2' ' A' ' 78' ' ' MET . 55.6 t -62.62 -59.16 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.318 -0.864 . . . . 0.0 110.024 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.639 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 15.8 t80 -46.78 -43.57 18.36 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.253 -0.904 . . . . 0.0 110.055 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.497 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 7.5 mmtp -65.18 -37.11 86.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.256 -0.902 . . . . 0.0 110.166 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.742 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -65.9 -27.24 68.05 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.224 -0.922 . . . . 0.0 110.015 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.785 ' SD ' ' HB2' ' A' ' 127' ' ' ALA . 0.0 OUTLIER -71.4 -39.39 71.17 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.363 -0.836 . . . . 0.0 110.396 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 39.1 m -63.68 -35.81 81.77 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.168 -0.958 . . . . 0.0 110.129 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.768 HD23 HG13 ' A' ' 24' ' ' VAL . 33.3 tp -75.98 -37.38 58.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.145 -0.972 . . . . 0.0 109.614 179.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.558 ' HE2' HD11 ' A' ' 64' ' ' LEU . 3.4 ttp -72.7 -20.85 61.15 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.269 -0.894 . . . . 0.0 109.97 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.58 ' CA ' HD11 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -89.79 -36.29 15.22 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.266 -0.896 . . . . 0.0 110.244 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.633 ' CE1' ' CG2' ' A' ' 87' ' ' THR . 22.6 t80 -73.25 -42.25 62.76 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.363 -0.835 . . . . 0.0 110.698 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.65 ' CB ' HG11 ' A' ' 92' ' ' VAL . 57.4 mt -67.4 -30.12 69.79 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.255 -0.903 . . . . 0.0 110.365 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.015 HG21 HD11 ' A' ' 134' ' ' LEU . 17.7 mt -68.66 -13.11 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.084 -1.01 . . . . 0.0 110.039 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.67 -66.96 0.91 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 109.971 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.633 ' CG2' ' CE1' ' A' ' 83' ' ' TYR . 11.5 t -97.13 8.11 45.21 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.341 -0.849 . . . . 0.0 109.94 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.619 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -95.93 30.81 7.97 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.516 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.8 OUTLIER 72.29 156.98 0.17 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.305 -1.115 . . . . 0.0 110.288 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 6.8 mt-10 -68.43 -9.96 52.01 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.275 -0.89 . . . . 0.0 110.507 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -69.59 -45.53 68.39 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.305 -0.872 . . . . 0.0 109.638 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.689 ' CG2' HG21 ' A' ' 47' ' ' THR . 99.3 t -52.76 -40.53 35.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 121.503 -0.748 . . . . 0.0 109.768 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.8 m -68.48 -39.32 81.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.296 -0.878 . . . . 0.0 109.506 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 90' ' ' GLU . 8.7 mt-30 -55.85 -35.5 66.5 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.331 -0.856 . . . . 0.0 109.397 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.535 ' HA ' ' HG2' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -70.08 -40.2 75.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.451 -0.78 . . . . 0.0 109.014 178.956 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.492 ' SG ' HD22 ' A' ' 134' ' ' LEU . 21.7 t -55.3 -31.95 62.05 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.239 -0.913 . . . . 0.0 108.959 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.9 mttt -82.14 -25.87 34.0 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.567 -0.708 . . . . 0.0 109.924 179.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.535 ' HG2' ' HA ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -75.36 -21.98 57.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 109.856 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.504 ' N ' ' HG3' ' A' ' 98' ' ' GLU . 22.6 t-20 -140.77 44.79 1.82 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.407 -0.808 . . . . 0.0 109.977 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 28.5 ttp -59.92 -36.07 76.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.908 . . . . 0.0 110.025 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.448 ' O ' ' HB ' ' A' ' 105' ' ' THR . 8.7 m-30 -57.62 -27.04 62.42 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.389 -0.819 . . . . 0.0 109.972 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.984 ' O ' HG22 ' A' ' 105' ' ' THR . . . -69.06 -41.5 77.51 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.385 -0.822 . . . . 0.0 110.085 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.463 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 3.4 t -73.88 -29.7 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.373 -0.83 . . . . 0.0 109.84 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.627 ' HG2' HG21 ' A' ' 131' ' ' VAL . 7.5 mt-30 -83.45 -20.18 34.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.417 -0.802 . . . . 0.0 110.219 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.984 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.5 t -72.34 -20.0 61.55 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.255 -0.903 . . . . 0.0 110.19 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.995 HD11 HD22 ' A' ' 64' ' ' LEU . 12.2 mt -64.3 -39.75 94.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.267 -0.896 . . . . 0.0 109.937 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 104' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.271 -0.893 . . . . 0.0 110.143 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.564 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.6 p . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 121.315 0.579 . . . . 0.0 110.223 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.564 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.7 OUTLIER -39.37 -44.01 1.27 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.59 -0.694 . . . . 0.0 110.61 -179.843 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.65 HG13 ' HE1' ' A' ' 78' ' ' MET . 1.4 t -78.86 -48.67 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.339 -0.85 . . . . 0.0 110.202 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.445 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -44.04 -51.05 8.14 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.272 -0.893 . . . . 0.0 111.201 -179.365 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.486 ' OE2' ' HA ' ' A' ' 122' ' ' ASN . 14.2 pt-20 -72.72 -34.26 66.99 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.273 -0.892 . . . . 0.0 111.186 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.744 ' HB3' ' HE3' ' A' ' 78' ' ' MET . 0.8 OUTLIER -59.04 -54.6 45.29 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.972 -1.08 . . . . 0.0 110.289 -179.776 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.785 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -59.83 -42.94 94.66 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.338 -0.851 . . . . 0.0 110.488 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -60.5 -34.62 74.34 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.236 -0.915 . . . . 0.0 110.477 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.537 ' O ' ' HB3' ' A' ' 132' ' ' ALA . 1.9 mt-30 -65.48 -42.87 91.72 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.298 -0.876 . . . . 0.0 110.48 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.846 HD21 HD12 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -58.14 -56.09 26.53 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.034 -1.042 . . . . 0.0 109.948 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.627 HG21 ' HG2' ' A' ' 104' ' ' GLN . 55.4 t -53.78 -23.6 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.449 -0.782 . . . . 0.0 109.837 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 129' ' ' GLN . . . -76.22 -56.12 4.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.447 -0.783 . . . . 0.0 110.503 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.98 -34.16 54.67 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.342 -0.849 . . . . 0.0 110.582 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 1.015 HD11 HG21 ' A' ' 85' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.188 -0.945 . . . . 0.0 110.451 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.433 ' OE1' HD21 ' A' ' 46' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 121.173 0.511 . . . . 0.0 110.675 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.899 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -71.16 -55.23 8.58 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.193 -0.942 . . . . 0.0 110.625 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HG3' HG12 ' A' ' 22' ' ' ILE . 19.7 pt-20 -41.01 -27.45 0.06 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.291 -0.881 . . . . 0.0 110.461 -179.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.465 HG12 ' HG3' ' A' ' 21' ' ' GLU . 23.5 mm -82.74 -57.81 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.271 -0.893 . . . . 0.0 110.308 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.866 ' O ' HD11 ' A' ' 43' ' ' ILE . 26.2 mttt -53.9 -19.05 3.96 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.241 -0.912 . . . . 0.0 110.409 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.934 HG21 ' HA ' ' A' ' 56' ' ' ILE . 6.7 t -89.32 -37.39 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.204 -0.935 . . . . 0.0 110.12 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.501 ' NH2' ' NH1' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -64.66 -36.95 85.93 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.295 -0.878 . . . . 0.0 110.228 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -85.19 -40.56 16.55 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.273 -0.892 . . . . 0.0 110.259 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.613 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . . . -49.48 -38.51 30.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 0.0 110.174 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.578 HG22 ' HA ' ' A' ' 77' ' ' ALA . 63.6 p . . . . . 0 N--CA 1.492 1.67 0 O-C-N 121.307 -0.87 . . . . 0.0 110.25 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.613 ' CD1' ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.247 0.546 . . . . 0.0 110.319 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.574 ' HG3' ' CG ' ' A' ' 83' ' ' TYR . 36.2 tpp -82.17 -60.14 2.32 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.514 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 7.8 t -56.89 -21.51 30.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.303 -0.873 . . . . 0.0 110.267 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -76.51 -55.78 5.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -0.906 . . . . 0.0 110.221 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.95 HG21 HD11 ' A' ' 80' ' ' LEU . 36.2 mt -49.03 -36.64 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.18 -0.95 . . . . 0.0 110.157 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.521 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -67.63 -55.0 15.04 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.204 -0.935 . . . . 0.0 109.489 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.42 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 22.8 m-20 -50.08 -23.45 2.11 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.097 -1.002 . . . . 0.0 109.14 179.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.923 ' HB3' HD11 ' A' ' 56' ' ' ILE . 7.4 mt -79.1 -40.35 31.36 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.581 -0.699 . . . . 0.0 109.91 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.707 HG21 ' HB3' ' A' ' 84' ' ' LEU . 80.7 p -47.54 -39.71 17.07 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.177 -0.952 . . . . 0.0 109.174 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.575 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 57.9 m-85 -46.06 -50.3 15.36 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 119.384 -0.926 . . . . 0.0 109.289 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.529 ' O ' ' C ' ' A' ' 50' ' ' VAL . 16.5 m-20 -68.14 91.21 0.35 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.57 0.7 . . . . 0.0 110.765 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.529 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -11.0 -57.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.712 178.138 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.527 ' N ' ' O ' ' A' ' 49' ' ' ASN . 2.9 t -64.92 -66.25 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 120.928 -1.108 . . . . 0.0 110.301 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.612 ' O ' HD12 ' A' ' 56' ' ' ILE . . . -37.57 -40.45 0.39 Allowed 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 121.146 0.498 . . . . 0.0 110.762 -177.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.599 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 15.1 t80 -59.07 -54.01 51.9 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.334 -0.854 . . . . 0.0 109.998 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.5 t -55.97 -33.22 64.58 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.19 -0.944 . . . . 0.0 109.862 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -75.42 -27.1 58.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.327 -0.858 . . . . 0.0 109.898 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.934 ' HA ' HG21 ' A' ' 24' ' ' VAL . 8.7 mt -79.68 -70.13 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.394 -0.816 . . . . 0.0 110.026 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.599 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 75.3 mmm -46.59 -36.35 6.8 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.274 -0.891 . . . . 0.0 109.563 179.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.4 m -55.16 -62.49 1.63 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.366 -0.834 . . . . 0.0 109.939 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.428 ' H ' ' HE3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -59.35 -21.4 59.76 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.188 -0.945 . . . . 0.0 109.798 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.549 ' CG1' HD23 ' A' ' 80' ' ' LEU . 1.0 OUTLIER -76.08 -30.29 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.41 -0.806 . . . . 0.0 109.748 179.871 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.44 ' CD1' ' O ' ' A' ' 57' ' ' MET . 14.0 m95 -76.13 -46.73 27.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.307 -0.87 . . . . 0.0 110.346 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.3 mptt -55.84 -47.67 76.83 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.25 -0.906 . . . . 0.0 110.392 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.501 ' NH1' ' NH2' ' A' ' 25' ' ' ARG . 6.0 mmp_? -75.88 -10.9 59.81 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.326 -0.859 . . . . 0.0 110.338 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.817 ' O ' HD21 ' A' ' 106' ' ' LEU . 6.6 mt -83.55 -17.68 40.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.194 -0.941 . . . . 0.0 110.351 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.5 m-20 . . . . . 0 C--N 1.302 -1.464 0 O-C-N 121.329 -0.857 . . . . 0.0 110.073 -179.567 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.541 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 28.7 p-90 . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.21 0.529 . . . . 0.0 110.332 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.541 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 15.2 mtm-85 -48.85 -40.8 30.91 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.208 -0.933 . . . . 0.0 110.235 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 17.0 m170 -68.04 -47.81 67.37 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.234 -0.917 . . . . 0.0 110.094 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.631 HG11 ' CG1' ' A' ' 123' ' ' VAL . 7.0 t -46.37 -52.42 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.349 -0.844 . . . . 0.0 110.172 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.53 ' CZ ' ' ND2' ' A' ' 122' ' ' ASN . 19.8 t80 -54.87 -49.05 72.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.342 -0.849 . . . . 0.0 110.33 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.539 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 10.9 mttm -61.92 -22.81 65.9 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.24 -0.913 . . . . 0.0 110.091 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.754 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -80.05 -23.92 41.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.239 -0.913 . . . . 0.0 109.936 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.556 ' HE2' HG12 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -73.81 -38.45 64.57 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.332 -0.855 . . . . 0.0 110.004 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 76' ' ' LYS . 8.9 t -72.1 -34.32 68.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.207 -0.933 . . . . 0.0 110.046 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.95 HD11 HG21 ' A' ' 43' ' ' ILE . 10.1 tp -68.41 -62.0 1.59 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.232 -0.917 . . . . 0.0 108.994 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.819 ' HE1' HG22 ' A' ' 103' ' ' VAL . 2.9 ttm -53.69 -32.32 51.29 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.406 -0.808 . . . . 0.0 109.9 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.7 ' HA ' HD12 ' A' ' 85' ' ' ILE . 2.8 tt0 -72.74 -32.82 65.96 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.247 -0.908 . . . . 0.0 109.634 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.574 ' CG ' ' HG3' ' A' ' 40' ' ' MET . 20.9 t80 -70.75 -38.88 73.53 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.543 -0.723 . . . . 0.0 110.487 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.788 ' HB2' HG11 ' A' ' 92' ' ' VAL . 1.7 mt -70.55 -32.98 70.62 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.107 -0.995 . . . . 0.0 109.578 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.927 HD13 HD21 ' A' ' 134' ' ' LEU . 71.5 mt -61.76 -26.34 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.181 -0.949 . . . . 0.0 110.082 179.654 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.02 -70.64 0.62 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.385 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.521 HG23 ' HB1' ' A' ' 44' ' ' ALA . 13.0 t -94.1 -23.05 18.12 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.236 -0.915 . . . . 0.0 110.4 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.575 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -44.36 -84.54 0.01 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' A' ' 88' ' ' GLY . 14.4 p -178.09 156.37 1.02 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.234 -1.156 . . . . 0.0 110.31 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.78 -21.56 11.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.282 -0.886 . . . . 0.0 110.2 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -70.74 -44.84 65.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.928 . . . . 0.0 109.86 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.788 HG11 ' HB2' ' A' ' 84' ' ' LEU . 55.2 t -53.27 -38.45 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.361 -0.837 . . . . 0.0 109.958 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 96' ' ' CYS . 70.5 m -70.79 -41.06 72.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.316 -0.865 . . . . 0.0 109.98 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.417 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 31.3 mm-40 -57.07 -54.88 41.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.304 -0.872 . . . . 0.0 109.992 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.9 tp60 -55.86 -36.8 67.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.424 -0.797 . . . . 0.0 109.877 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 93' ' ' SER . 4.8 m -60.15 -36.37 77.38 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.315 -0.865 . . . . 0.0 109.736 179.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -74.92 -31.8 61.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.683 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 82.2 mt-10 -81.23 -14.78 57.13 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.473 -0.767 . . . . 0.0 110.027 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -123.18 32.87 5.54 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.281 -0.887 . . . . 0.0 110.174 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.6 ttm -58.2 -24.7 60.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.325 -0.86 . . . . 0.0 110.133 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.462 ' O ' ' HB ' ' A' ' 105' ' ' THR . 14.5 m-85 -69.07 -31.83 70.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.919 . . . . 0.0 110.104 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.933 ' O ' HG22 ' A' ' 105' ' ' THR . . . -75.08 -40.03 60.36 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.48 -0.763 . . . . 0.0 110.26 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.819 HG22 ' HE1' ' A' ' 81' ' ' MET . 3.6 t -71.63 -32.37 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.418 -0.801 . . . . 0.0 110.14 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -86.0 -23.36 26.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.281 -0.887 . . . . 0.0 110.508 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.933 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.3 t -51.37 -25.69 6.49 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.082 -1.011 . . . . 0.0 110.002 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.817 HD21 ' O ' ' A' ' 64' ' ' LEU . 50.5 mt -62.39 -43.55 98.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.309 -0.869 . . . . 0.0 110.077 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.51 ' HA ' ' HG2' ' A' ' 124' ' ' ARG . 49.0 mttt . . . . . 0 N--CA 1.492 1.634 0 O-C-N 121.191 -0.943 . . . . 0.0 109.965 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.375 0.607 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 3.7 t30 -36.12 -30.33 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.143 0.497 . . . . 0.0 110.582 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.631 ' CG1' HG11 ' A' ' 74' ' ' VAL . 4.6 t -78.16 -58.45 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 0.0 109.826 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.51 ' HG2' ' HA ' ' A' ' 107' ' ' LYS . 10.4 mtp-105 -42.1 -47.29 4.52 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.243 -0.91 . . . . 0.0 111.038 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -72.28 -48.56 41.49 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.381 -0.825 . . . . 0.0 111.662 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.541 ' HA ' ' CE ' ' A' ' 126' ' ' LYS . 0.0 OUTLIER -52.04 -53.6 40.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.837 -1.164 . . . . 0.0 110.15 -179.278 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.462 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -52.2 -43.25 64.1 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.341 -0.849 . . . . 0.0 110.146 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.3 tmmm? -55.21 -36.59 66.12 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.207 -0.933 . . . . 0.0 110.371 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -57.45 3.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.161 -0.962 . . . . 0.0 110.294 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 1.039 ' O ' HD23 ' A' ' 134' ' ' LEU . 12.2 tp -46.88 -25.5 0.78 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.208 -0.933 . . . . 0.0 110.041 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 30.0 t -86.64 -36.47 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.219 -0.925 . . . . 0.0 110.155 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.73 -60.46 3.07 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.218 -0.927 . . . . 0.0 110.22 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.98 -28.41 9.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.056 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 1.039 HD23 ' O ' ' A' ' 130' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.28 -0.888 . . . . 0.0 110.261 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.36 0.6 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.893 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -58.53 -46.42 86.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.378 -0.826 . . . . 0.0 110.286 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.474 ' OE2' ' CG1' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -43.71 -28.28 0.4 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.14 -0.975 . . . . 0.0 110.081 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.474 ' CG1' ' OE2' ' A' ' 21' ' ' GLU . 9.9 mt -86.76 -54.08 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.291 -0.881 . . . . 0.0 110.133 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.544 ' O ' HD11 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -44.6 -37.87 3.88 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 110.153 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.771 HG21 ' HA ' ' A' ' 56' ' ' ILE . 51.2 t -75.06 -48.57 31.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.232 -0.917 . . . . 0.0 110.145 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -46.66 -41.19 14.42 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.136 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.407 ' O ' ' C ' ' A' ' 27' ' ' ALA . 0.0 OUTLIER -74.05 -47.46 36.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.333 -0.855 . . . . 0.0 110.107 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.697 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -44.44 -47.17 9.88 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.235 -0.916 . . . . 0.0 110.078 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.511 ' HA ' ' HB2' ' A' ' 76' ' ' LYS . 39.5 p . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.32 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.697 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.274 0.559 . . . . 0.0 110.25 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -50.67 22.71 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 110.218 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.434 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 89.0 p -58.47 -29.19 65.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -73.11 -47.65 42.47 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.266 -0.896 . . . . 0.0 110.241 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.906 HG21 HD11 ' A' ' 80' ' ' LEU . 23.1 mt -57.68 -38.65 65.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.233 -0.917 . . . . 0.0 110.226 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.649 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -68.61 -47.18 67.34 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.058 -1.027 . . . . 0.0 109.43 179.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.509 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 3.6 t70 -55.41 -18.48 6.94 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.117 -0.99 . . . . 0.0 109.12 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.893 HD13 ' CB ' ' A' ' 20' ' ' ALA . 24.7 mt -85.22 -33.52 22.22 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.531 -0.73 . . . . 0.0 110.191 179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.592 HG21 ' HB3' ' A' ' 84' ' ' LEU . 38.9 p -56.08 -43.74 78.31 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.0 -1.062 . . . . 0.0 109.233 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.544 ' CE2' ' O ' ' A' ' 87' ' ' THR . 95.0 m-85 -41.26 -37.51 0.97 Allowed 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.59 179.537 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.542 ' O ' ' C ' ' A' ' 50' ' ' VAL . 0.8 OUTLIER -80.66 91.21 5.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.591 -0.693 . . . . 0.0 110.365 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.542 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.09 -58.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.26 178.095 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.541 ' N ' ' O ' ' A' ' 49' ' ' ASN . 2.9 t -65.11 -66.03 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.032 -1.042 . . . . 0.0 110.143 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.742 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -38.19 -44.5 0.86 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.295 0.569 . . . . 0.0 110.522 -177.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.543 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 0.6 OUTLIER -56.73 -55.85 28.88 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.425 -0.797 . . . . 0.0 109.925 179.715 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -54.67 -31.81 58.29 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.194 -0.941 . . . . 0.0 110.232 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -77.79 -26.94 50.04 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.307 -0.871 . . . . 0.0 110.193 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.771 ' HA ' HG21 ' A' ' 24' ' ' VAL . 6.3 mt -78.36 -70.3 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.326 -0.859 . . . . 0.0 110.216 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.466 ' HB3' ' HE2' ' A' ' 57' ' ' MET . 3.5 mtp -46.64 -35.48 6.0 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.177 -0.952 . . . . 0.0 109.762 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 t -55.85 -60.97 2.7 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.258 -0.901 . . . . 0.0 109.659 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.458 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.6 OUTLIER -60.45 -20.14 58.86 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.266 -0.897 . . . . 0.0 109.679 179.47 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.627 HD11 ' HG ' ' A' ' 80' ' ' LEU . 1.2 mt -75.67 -31.18 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.413 -0.804 . . . . 0.0 109.645 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -74.74 -50.27 18.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -0.906 . . . . 0.0 110.202 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -56.14 18.4 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.249 -0.907 . . . . 0.0 110.327 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -68.61 -14.18 62.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.246 -0.909 . . . . 0.0 110.427 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.8 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 4.1 mt -77.69 -25.25 49.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.22 -0.925 . . . . 0.0 110.569 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.4 m120 . . . . . 0 C--N 1.301 -1.509 0 O-C-N 121.343 -0.848 . . . . 0.0 110.185 -179.638 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.123 0.487 . . . . 0.0 110.25 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -47.5 -35.82 9.37 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.161 -0.962 . . . . 0.0 109.592 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -61.73 -47.86 83.33 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.343 -0.848 . . . . 0.0 109.742 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.636 HG12 ' HE1' ' A' ' 78' ' ' MET . 58.9 t -50.67 -46.19 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.331 -0.855 . . . . 0.0 109.715 179.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.808 ' HB2' HG23 ' A' ' 123' ' ' VAL . 8.4 t80 -57.18 -52.18 66.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.321 -0.862 . . . . 0.0 109.804 179.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.511 ' HB2' ' HA ' ' A' ' 28' ' ' THR . 25.9 mmmt -62.54 -19.37 63.59 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.298 -0.877 . . . . 0.0 109.768 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.8 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -79.48 -30.97 42.28 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.399 -0.813 . . . . 0.0 109.927 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 1.028 ' HE1' HG22 ' A' ' 123' ' ' VAL . 1.2 mpp? -68.36 -46.47 70.01 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 109.859 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.8 t -67.57 -31.86 72.22 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.249 -0.907 . . . . 0.0 109.808 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.906 HD11 HG21 ' A' ' 43' ' ' ILE . 11.2 tp -66.3 -65.4 0.68 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.347 -0.846 . . . . 0.0 109.033 178.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.928 ' HG2' HD21 ' A' ' 130' ' ' LEU . 9.3 ttt -49.38 -32.75 12.1 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.406 -0.809 . . . . 0.0 110.122 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.717 ' HA ' HD12 ' A' ' 85' ' ' ILE . 1.3 tm-20 -70.36 -38.07 74.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.102 -0.999 . . . . 0.0 110.025 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.834 ' CE1' HG21 ' A' ' 87' ' ' THR . 19.7 t80 -68.21 -34.31 76.01 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.255 -0.903 . . . . 0.0 110.677 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.874 ' HB2' HG11 ' A' ' 92' ' ' VAL . 2.8 mt -80.76 -21.79 40.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.019 -1.051 . . . . 0.0 109.924 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.015 HD13 HD11 ' A' ' 134' ' ' LEU . 19.9 mt -65.93 -24.64 34.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.154 -0.966 . . . . 0.0 109.534 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -103.31 -61.38 1.42 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.361 -0.837 . . . . 0.0 109.901 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.834 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.0 t -98.34 11.39 38.18 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.299 -0.876 . . . . 0.0 109.974 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.652 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -102.2 29.69 11.96 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 72.6 153.32 0.13 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.391 -1.064 . . . . 0.0 110.43 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.78 -8.71 22.88 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.367 -0.833 . . . . 0.0 110.378 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.416 ' O ' ' HB2' ' A' ' 94' ' ' GLN . 10.4 mmp_? -70.96 -45.07 64.75 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.284 -0.885 . . . . 0.0 109.842 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.874 HG11 ' HB2' ' A' ' 84' ' ' LEU . 91.0 t -52.45 -47.09 47.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 O-C-N 121.409 -0.807 . . . . 0.0 109.898 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.8 t -64.55 -36.78 85.34 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.215 -0.928 . . . . 0.0 109.92 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.477 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 56.3 mm-40 -58.08 -46.65 85.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.248 -0.908 . . . . 0.0 109.844 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.457 ' HB3' ' SD ' ' A' ' 57' ' ' MET . 0.1 OUTLIER -60.25 -39.82 88.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.835 . . . . 0.0 109.59 179.415 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.823 ' SG ' HD22 ' A' ' 134' ' ' LEU . 51.5 t -55.02 -40.82 70.59 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.364 -0.835 . . . . 0.0 109.564 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -29.58 64.75 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.48 -0.763 . . . . 0.0 109.669 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 0.5 OUTLIER -81.83 -12.52 58.46 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.479 -0.763 . . . . 0.0 110.006 179.788 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.419 ' OD1' ' O ' ' A' ' 98' ' ' GLU . 70.4 m-20 -137.15 42.18 2.42 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.309 -0.869 . . . . 0.0 110.047 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -35.67 75.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.272 -0.893 . . . . 0.0 110.237 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.464 ' O ' ' HB ' ' A' ' 105' ' ' THR . 25.4 m-85 -60.97 -25.88 67.16 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.387 -0.821 . . . . 0.0 110.145 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.939 ' O ' HG22 ' A' ' 105' ' ' THR . . . -74.54 -40.82 61.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.332 -0.855 . . . . 0.0 110.159 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.515 HG13 HD23 ' A' ' 130' ' ' LEU . 3.0 t -74.57 -26.52 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.337 -0.852 . . . . 0.0 110.049 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -88.59 -24.02 22.96 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.303 -0.873 . . . . 0.0 110.405 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.939 HG22 ' O ' ' A' ' 102' ' ' ALA . 14.0 t -61.79 -23.75 66.41 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.129 -0.982 . . . . 0.0 110.147 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.759 HD11 HD22 ' A' ' 64' ' ' LEU . 10.6 mt -70.44 -40.44 73.76 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 110.085 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.493 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 110.349 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.6 p . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 121.468 0.651 . . . . 0.0 110.03 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 6.5 t30 -43.29 -45.7 6.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.379 -0.825 . . . . 0.0 110.344 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 1.028 HG22 ' HE1' ' A' ' 78' ' ' MET . 1.2 t -82.2 -37.25 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.196 -0.94 . . . . 0.0 110.059 -179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.493 ' HG3' ' HA ' ' A' ' 107' ' ' LYS . 31.1 ttp180 -53.6 -61.5 2.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.08 -1.012 . . . . 0.0 110.837 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 78.9 mt-10 -65.76 -40.65 92.28 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.351 -0.843 . . . . 0.0 111.259 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.519 ' HG3' ' HB3' ' A' ' 78' ' ' MET . 11.2 tptm -52.68 -51.06 61.89 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.073 -1.017 . . . . 0.0 110.203 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.491 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -58.73 -45.54 89.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.378 -0.826 . . . . 0.0 109.958 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.0 tttm -49.66 -46.41 49.68 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.264 -0.897 . . . . 0.0 109.917 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.64 -51.01 68.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.318 -0.864 . . . . 0.0 110.091 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.928 HD21 ' HG2' ' A' ' 81' ' ' MET . 20.5 tp -47.61 -30.69 3.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.214 -0.929 . . . . 0.0 110.04 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.44 HG23 ' CG1' ' A' ' 103' ' ' VAL . 28.2 t -81.52 -34.76 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.332 -0.855 . . . . 0.0 110.287 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.438 ' O ' ' N ' ' A' ' 134' ' ' LEU . . . -71.52 -60.36 2.27 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.324 -0.86 . . . . 0.0 110.539 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 132' ' ' ALA . 0.8 OUTLIER -42.1 -26.77 0.11 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 110.387 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 1.015 HD11 HD13 ' A' ' 85' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 O-C-N 121.279 -0.888 . . . . 0.0 110.211 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.215 0.531 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.694 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -68.55 -41.04 80.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.272 -0.893 . . . . 0.0 110.191 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.475 ' HG3' HG13 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -55.11 -25.86 34.35 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.281 -0.887 . . . . 0.0 110.248 -180.0 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.475 HG13 ' HG3' ' A' ' 21' ' ' GLU . 40.8 mt -80.47 -44.9 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.258 -0.901 . . . . 0.0 110.273 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.533 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 2.1 mtmm -62.75 -32.18 73.26 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.238 -0.914 . . . . 0.0 110.122 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.852 HG21 ' HA ' ' A' ' 56' ' ' ILE . 33.1 t -71.24 -41.32 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.309 -0.869 . . . . 0.0 110.11 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -56.9 -42.49 79.99 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 110.027 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -72.97 -38.15 66.81 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.376 -0.827 . . . . 0.0 110.056 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.795 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -63.96 -22.16 66.8 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.304 -0.873 . . . . 0.0 110.094 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.88 HG22 ' HA ' ' A' ' 77' ' ' ALA . 13.2 p . . . . . 0 N--CA 1.491 1.613 0 O-C-N 121.259 -0.901 . . . . 0.0 110.17 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.795 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.338 0.589 . . . . 0.0 110.215 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.529 ' CE ' HG22 ' A' ' 79' ' ' THR . 4.2 mmt -86.88 -47.64 8.84 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 110.201 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.485 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 7.2 t -57.87 -19.78 31.88 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.266 -0.896 . . . . 0.0 110.143 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.424 ' OE2' ' HD3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -82.0 -58.13 3.1 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.237 -0.915 . . . . 0.0 110.192 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.653 HG21 HD21 ' A' ' 80' ' ' LEU . 96.4 mt -50.41 -35.56 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.163 -0.961 . . . . 0.0 109.937 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.621 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -67.32 -54.27 22.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.317 -0.864 . . . . 0.0 109.509 179.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.1 -21.88 3.65 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.159 -0.963 . . . . 0.0 108.988 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.705 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 14.1 mt -81.73 -37.83 26.68 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.574 -0.704 . . . . 0.0 109.927 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.509 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 80.6 p -49.77 -40.91 42.83 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.071 -1.018 . . . . 0.0 109.243 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.587 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 72.4 m-85 -44.39 -47.09 9.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.233 -0.917 . . . . 0.0 109.317 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.547 ' O ' ' C ' ' A' ' 50' ' ' VAL . 2.8 m120 -70.14 90.71 0.67 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.707 -0.621 . . . . 0.0 110.432 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.547 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.58 -58.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.269 178.099 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.546 ' H ' HG23 ' A' ' 50' ' ' VAL . 2.6 t -61.75 -64.4 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.096 -1.002 . . . . 0.0 109.943 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.705 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.89 -45.24 0.84 Allowed 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.759 -177.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.568 ' CD1' HG22 ' A' ' 92' ' ' VAL . 20.6 t80 -60.99 -53.95 50.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.292 -0.88 . . . . 0.0 110.166 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.52 -30.29 40.82 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.291 -0.88 . . . . 0.0 109.946 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -80.15 -29.38 38.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.428 -0.795 . . . . 0.0 110.01 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.852 ' HA ' HG21 ' A' ' 24' ' ' VAL . 10.3 mt -77.79 -69.63 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.356 -0.84 . . . . 0.0 110.09 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.636 ' HE2' ' HG3' ' A' ' 95' ' ' GLN . 0.2 OUTLIER -45.96 -35.45 4.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.27 -0.894 . . . . 0.0 110.111 179.732 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.5 t -58.36 -66.09 0.54 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.279 -0.888 . . . . 0.0 110.197 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.09 -17.24 16.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.301 -0.875 . . . . 0.0 109.986 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.901 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.7 OUTLIER -79.12 -33.15 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.37 -0.831 . . . . 0.0 109.813 179.809 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.602 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 12.2 m95 -75.74 -41.78 52.39 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.251 -0.905 . . . . 0.0 110.111 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.1 -57.7 11.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.306 -0.871 . . . . 0.0 110.13 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -66.88 -11.57 56.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 110.12 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.923 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 3.7 mt -80.32 -22.19 41.75 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.197 -0.94 . . . . 0.0 110.265 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.9 t30 . . . . . 0 C--N 1.304 -1.377 0 O-C-N 121.243 -0.911 . . . . 0.0 109.966 -179.979 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.468 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 64.9 p-90 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.283 0.563 . . . . 0.0 110.238 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -43.98 -49.84 8.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.257 -0.902 . . . . 0.0 110.108 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -54.08 -49.1 69.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 110.2 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.697 ' CG1' HD13 ' A' ' 106' ' ' LEU . 25.0 t -49.48 -49.95 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.325 -0.86 . . . . 0.0 110.278 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.62 ' CE1' ' CD ' ' A' ' 126' ' ' LYS . 6.7 t80 -47.08 -55.25 8.65 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.284 -0.885 . . . . 0.0 110.586 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.527 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -66.88 -23.86 66.05 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.107 -0.996 . . . . 0.0 110.513 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.923 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -68.89 -68.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.234 -0.916 . . . . 0.0 110.378 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.804 ' HE3' HG23 ' A' ' 123' ' ' VAL . 0.3 OUTLIER -49.63 -31.96 11.93 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.381 -0.824 . . . . 0.0 110.192 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.529 HG22 ' CE ' ' A' ' 40' ' ' MET . 95.7 m -55.27 -56.3 21.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.14 -0.975 . . . . 0.0 109.646 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.901 ' CD2' HD11 ' A' ' 60' ' ' ILE . 29.7 tp -51.6 -66.62 0.35 Allowed 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.329 -0.857 . . . . 0.0 108.818 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.602 ' HE1' ' CZ3' ' A' ' 61' ' ' TRP . 47.3 ttm -41.32 -28.49 0.11 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.444 -0.785 . . . . 0.0 110.418 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.481 ' CB ' HD12 ' A' ' 130' ' ' LEU . 0.2 OUTLIER -72.3 -47.08 52.71 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.21 -0.931 . . . . 0.0 110.529 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.591 ' CE1' HG21 ' A' ' 87' ' ' THR . 33.6 t80 -70.54 -30.53 67.29 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.236 -0.915 . . . . 0.0 111.355 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.933 ' HB2' HG11 ' A' ' 92' ' ' VAL . 6.7 mt -75.26 -33.29 61.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.941 -1.1 . . . . 0.0 110.521 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.025 HG21 HD11 ' A' ' 134' ' ' LEU . 53.7 mt -62.15 -29.76 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 120.995 -1.065 . . . . 0.0 110.352 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.7 tttt -85.89 -71.13 0.55 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.245 -0.909 . . . . 0.0 110.541 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.591 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.0 t -94.34 -20.43 19.76 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.198 -0.938 . . . . 0.0 110.446 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.621 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -49.32 -66.4 2.25 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 3.5 t 171.98 158.21 0.09 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.099 -1.236 . . . . 0.0 110.256 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -63.46 -12.91 35.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.293 -0.879 . . . . 0.0 110.263 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.464 ' HD3' ' O ' ' A' ' 47' ' ' THR . 3.9 ptm85 -84.67 -29.18 25.86 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -0.903 . . . . 0.0 110.237 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.933 HG11 ' HB2' ' A' ' 84' ' ' LEU . 59.9 t -67.65 -31.46 52.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.194 -0.941 . . . . 0.0 109.818 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 83.7 p -80.0 -39.19 30.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.324 -0.86 . . . . 0.0 109.712 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -61.58 -51.23 69.41 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.309 -0.87 . . . . 0.0 109.773 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.636 ' HG3' ' HE2' ' A' ' 57' ' ' MET . 5.3 tp-100 -57.67 -40.1 78.58 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.455 -0.778 . . . . 0.0 109.536 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 8.5 t -55.62 -37.87 68.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -0.873 . . . . 0.0 109.54 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.93 -32.61 67.5 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.437 -0.789 . . . . 0.0 109.705 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -71.16 -24.09 62.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.443 -0.786 . . . . 0.0 109.801 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.76 36.04 4.71 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.44 -0.788 . . . . 0.0 110.106 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . 0.461 ' O ' HG12 ' A' ' 103' ' ' VAL . 0.3 OUTLIER -59.69 -20.67 57.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.333 -0.854 . . . . 0.0 110.271 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.449 ' O ' ' HB ' ' A' ' 105' ' ' THR . 55.1 m-85 -76.24 -28.46 57.16 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.193 -0.942 . . . . 0.0 110.227 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.861 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.71 -39.03 53.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 110.222 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.579 ' CG1' ' N ' ' A' ' 104' ' ' GLN . 3.2 p -74.71 -42.03 47.75 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 CA-C-O 121.942 0.877 . . . . 0.0 109.08 179.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.717 ' OE1' HG21 ' A' ' 131' ' ' VAL . 14.3 mm100 -70.04 -21.78 63.15 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.556 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.861 HG22 ' O ' ' A' ' 102' ' ' ALA . 4.7 t -57.47 -16.08 8.64 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.986 -1.072 . . . . 0.0 109.994 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.76 HD11 HD22 ' A' ' 64' ' ' LEU . 76.4 mt -74.99 -37.42 61.87 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.263 -0.898 . . . . 0.0 110.382 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.495 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 2.8 pttp . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.223 -0.923 . . . . 0.0 110.136 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.557 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.4 p . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.64 0.733 . . . . 0.0 109.954 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.557 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 37.8 m-80 -47.77 -60.32 2.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.434 -0.791 . . . . 0.0 110.282 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.804 HG23 ' HE3' ' A' ' 78' ' ' MET . 14.9 p -72.46 -13.09 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.245 -0.909 . . . . 0.0 110.494 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.509 ' HB3' ' HA ' ' A' ' 121' ' ' VAL . 6.4 ttt180 -74.25 -69.02 0.47 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.14 -0.975 . . . . 0.0 110.563 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.46 -34.92 71.39 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.327 -0.858 . . . . 0.0 110.644 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.62 ' CD ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -58.31 -56.56 20.51 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.036 -1.04 . . . . 0.0 109.885 179.978 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.762 ' HB2' ' HE1' ' A' ' 78' ' ' MET . . . -54.5 -44.88 73.1 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 109.93 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.42 ' HE3' ' HD2' ' A' ' 107' ' ' LYS . 11.2 mtpt -57.29 -35.13 69.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.272 -0.893 . . . . 0.0 110.244 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.438 ' O ' ' HB3' ' A' ' 132' ' ' ALA . 5.2 tt0 -59.44 -48.29 82.22 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.295 -0.878 . . . . 0.0 110.422 -179.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.589 HD21 ' CD1' ' A' ' 85' ' ' ILE . 3.8 tt -55.19 -51.63 65.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.197 -0.939 . . . . 0.0 110.264 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.717 HG21 ' OE1' ' A' ' 104' ' ' GLN . 96.0 t -63.75 -26.89 41.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.423 -0.798 . . . . 0.0 110.387 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 129' ' ' GLN . . . -64.97 -47.03 79.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.278 -0.889 . . . . 0.0 110.186 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 mt -58.01 -48.87 78.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.265 -0.897 . . . . 0.0 110.406 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 1.025 HD11 HG21 ' A' ' 85' ' ' ILE . 9.6 mp . . . . . 0 N--CA 1.493 1.676 0 O-C-N 121.218 -0.926 . . . . 0.0 110.383 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.431 ' HB2' HD12 ' A' ' 22' ' ' ILE . 2.7 pt-20 . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.298 0.57 . . . . 0.0 110.188 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.85 ' HB2' HD13 ' A' ' 46' ' ' LEU . . . -54.16 -46.12 72.23 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 110.115 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 3.1 pt-20 -41.87 -46.73 4.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.387 -0.821 . . . . 0.0 110.418 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.435 HG13 ' HG3' ' A' ' 21' ' ' GLU . 63.3 mt -63.13 -44.21 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.223 -0.923 . . . . 0.0 110.023 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.526 ' CG ' HD21 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -57.22 -32.74 66.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.289 -0.882 . . . . 0.0 110.103 179.775 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.901 HG22 HD21 ' A' ' 80' ' ' LEU . 28.2 t -71.72 -28.06 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.148 -0.97 . . . . 0.0 110.018 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -45.32 64.04 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.204 -0.935 . . . . 0.0 109.985 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.435 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -78.54 -22.53 47.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.328 -0.857 . . . . 0.0 110.022 179.85 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.457 ' HB2' HD22 ' A' ' 39' ' ' LEU . . . -77.26 -21.98 52.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.294 -0.879 . . . . 0.0 110.218 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.444 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 25.2 p . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.225 -0.922 . . . . 0.0 110.199 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.587 HD22 HD11 ' A' ' 43' ' ' ILE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.22 0.533 . . . . 0.0 110.137 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.555 ' HG2' ' CG ' ' A' ' 83' ' ' TYR . 0.2 OUTLIER -77.97 -56.52 4.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.235 -0.915 . . . . 0.0 110.182 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.7 t -62.73 -29.89 71.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.271 -0.893 . . . . 0.0 110.386 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.47 -60.46 2.3 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.168 -0.957 . . . . 0.0 110.467 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.67 HG21 HD11 ' A' ' 80' ' ' LEU . 15.8 mt -50.39 -31.65 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.222 -0.924 . . . . 0.0 110.301 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.569 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -70.66 -51.31 28.69 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.071 -1.018 . . . . 0.0 109.418 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.499 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.5 OUTLIER -53.96 -20.6 6.43 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.102 -0.999 . . . . 0.0 108.892 178.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.85 HD13 ' HB2' ' A' ' 20' ' ' ALA . 20.4 mt -81.13 -37.02 29.54 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.535 -0.728 . . . . 0.0 109.954 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.506 ' O ' ' HB2' ' A' ' 53' ' ' PHE . 80.7 p -53.04 -42.87 66.14 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.099 -1.001 . . . . 0.0 109.099 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.499 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 93.1 m-85 -44.37 -42.22 6.71 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.267 -0.896 . . . . 0.0 109.511 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.532 ' O ' ' N ' ' A' ' 51' ' ' VAL . 5.3 m-80 -73.19 92.64 1.76 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.483 -0.761 . . . . 0.0 110.187 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.526 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.39 -57.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.657 178.343 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.542 HG12 ' N ' ' A' ' 52' ' ' ALA . 3.0 t -65.82 -66.38 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.963 -1.086 . . . . 0.0 110.482 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.725 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -36.01 -45.31 0.42 Allowed 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.161 0.505 . . . . 0.0 111.08 -177.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.636 ' CD1' HG22 ' A' ' 92' ' ' VAL . 6.0 t80 -55.68 -58.85 6.08 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.307 -0.871 . . . . 0.0 110.393 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.486 ' O ' ' HB2' ' A' ' 58' ' ' SER . 18.2 m -51.1 -42.03 60.38 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.165 -0.959 . . . . 0.0 110.44 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 1.5 mm-40 -66.33 -30.96 71.48 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.198 -0.939 . . . . 0.0 110.505 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.744 ' HA ' HG21 ' A' ' 24' ' ' VAL . 7.1 mt -74.23 -70.01 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.334 -0.854 . . . . 0.0 110.359 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.419 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 52.6 mmm -46.7 -38.27 9.62 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.131 -0.981 . . . . 0.0 110.128 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.486 ' HB2' ' O ' ' A' ' 54' ' ' SER . 23.2 t -52.7 -60.68 2.96 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.252 -0.905 . . . . 0.0 110.26 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.55 ' HB3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -58.23 -31.47 67.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.142 -0.974 . . . . 0.0 109.858 179.793 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.7 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -66.92 -29.59 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.411 -0.806 . . . . 0.0 109.917 179.883 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.548 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 19.7 m95 -79.39 -41.67 27.22 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.247 -0.908 . . . . 0.0 110.434 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.53 -66.3 0.46 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.249 -0.907 . . . . 0.0 110.636 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -61.37 -23.9 66.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.916 . . . . 0.0 110.606 -179.602 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.868 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 3.8 mt -60.78 -27.34 67.92 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.151 -0.968 . . . . 0.0 110.337 -179.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.5 t30 . . . . . 0 C--N 1.303 -1.432 0 O-C-N 121.286 -0.883 . . . . 0.0 110.014 179.96 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.55 ' HB2' HG21 ' A' ' 123' ' ' VAL . 33.1 p-90 . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.281 0.562 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -45.92 -46.76 16.24 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.298 -0.876 . . . . 0.0 110.285 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -59.81 -40.01 86.98 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.234 -0.916 . . . . 0.0 110.258 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.837 HG12 ' HE2' ' A' ' 78' ' ' MET . 49.6 t -62.02 -57.32 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.172 -0.955 . . . . 0.0 110.272 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 74' ' ' VAL . 4.6 t80 -42.38 -54.54 3.76 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.299 -0.875 . . . . 0.0 110.315 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.444 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -61.11 -36.69 80.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.19 -0.944 . . . . 0.0 110.263 179.932 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.868 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -62.41 -25.87 68.18 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.235 -0.916 . . . . 0.0 110.159 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.837 ' HE2' HG12 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -78.57 -35.32 46.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.198 -0.939 . . . . 0.0 110.177 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 25.6 m -60.26 -55.26 35.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 0.0 109.997 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.901 HD21 HG22 ' A' ' 24' ' ' VAL . 25.5 tp -59.91 -34.63 73.46 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.456 -0.778 . . . . 0.0 109.964 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.65 ' CE ' HD11 ' A' ' 64' ' ' LEU . 15.9 ttm -66.39 -33.74 76.4 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.137 -0.977 . . . . 0.0 110.122 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.746 ' HB2' HD12 ' A' ' 130' ' ' LEU . 3.7 tp10 -77.74 -63.83 1.29 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.295 -0.878 . . . . 0.0 110.144 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.742 ' CE1' HG21 ' A' ' 87' ' ' THR . 54.0 t80 -41.27 -49.65 3.66 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.418 -0.801 . . . . 0.0 110.641 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.535 ' CB ' HG11 ' A' ' 92' ' ' VAL . 81.6 mt -64.72 -43.78 92.32 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.311 -0.868 . . . . 0.0 110.337 -179.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.931 HD11 ' SG ' ' A' ' 96' ' ' CYS . 13.5 mt -49.69 -25.98 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.086 -1.009 . . . . 0.0 109.768 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.8 mttp -97.18 -81.36 0.43 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 110.053 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.742 HG21 ' CE1' ' A' ' 83' ' ' TYR . 13.0 t -72.64 -24.67 61.08 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.301 -0.874 . . . . 0.0 110.271 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.445 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -47.22 -77.23 0.11 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.451 ' HB3' HG23 ' A' ' 92' ' ' VAL . 26.7 t -179.17 155.98 0.75 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.159 -1.2 . . . . 0.0 110.326 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -56.91 -17.79 10.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.288 -0.882 . . . . 0.0 110.177 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -83.25 -37.07 24.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.323 -0.86 . . . . 0.0 110.175 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.636 HG22 ' CD1' ' A' ' 53' ' ' PHE . 59.2 t -59.92 -32.14 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.292 -0.88 . . . . 0.0 110.085 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.0 t -79.01 -40.75 30.63 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.0 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.527 ' O ' ' CG ' ' A' ' 97' ' ' LYS . 38.9 mt-30 -65.58 -26.14 67.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 109.867 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -35.91 60.91 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.244 -0.91 . . . . 0.0 109.519 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . 0.931 ' SG ' HD11 ' A' ' 85' ' ' ILE . 1.3 m -65.61 -37.9 87.92 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.33 -0.856 . . . . 0.0 109.669 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.527 ' CG ' ' O ' ' A' ' 94' ' ' GLN . 0.2 OUTLIER -72.8 -28.14 62.4 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.339 -0.851 . . . . 0.0 109.596 179.349 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.507 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 7.7 mm-40 -75.32 -29.99 60.17 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.368 -0.832 . . . . 0.0 109.348 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.408 ' OD1' ' HB2' ' A' ' 102' ' ' ALA . 22.1 t-20 -116.66 44.38 2.04 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.502 -0.749 . . . . 0.0 109.583 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -29.27 69.78 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.431 -0.793 . . . . 0.0 110.259 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.483 ' O ' ' HB ' ' A' ' 105' ' ' THR . 57.9 m-85 -66.44 -24.92 66.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.205 -0.934 . . . . 0.0 109.779 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.898 ' O ' HG22 ' A' ' 105' ' ' THR . . . -77.47 -41.32 39.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.462 -0.774 . . . . 0.0 110.112 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.599 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 4.0 t -72.33 -31.01 37.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.356 -0.84 . . . . 0.0 110.156 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.497 ' O ' ' CG ' ' A' ' 107' ' ' LYS . 7.5 mm-40 -86.91 -19.41 28.89 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 110.426 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.898 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.6 t -54.7 -18.9 5.17 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.931 . . . . 0.0 109.927 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.619 HD22 HG11 ' A' ' 74' ' ' VAL . 91.3 mt -79.41 -35.65 40.31 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.389 -0.819 . . . . 0.0 110.118 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.593 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.263 -0.898 . . . . 0.0 110.32 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.558 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.3 p . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 121.388 0.613 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.558 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 6.0 t30 -39.19 -31.77 0.08 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.66 -0.65 . . . . 0.0 110.361 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.629 HG13 ' HE1' ' A' ' 78' ' ' MET . 2.3 t -83.49 -52.62 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.304 -0.872 . . . . 0.0 109.93 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.593 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 4.4 mtp180 -44.79 -43.67 8.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.142 -0.974 . . . . 0.0 111.176 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -79.33 -46.15 18.25 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.195 -0.94 . . . . 0.0 111.769 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . 0.543 ' CD ' ' HB2' ' A' ' 78' ' ' MET . 0.0 OUTLIER -53.66 -54.92 30.88 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.919 -1.113 . . . . 0.0 110.109 -179.511 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.81 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -55.46 -44.22 76.21 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.437 -0.789 . . . . 0.0 110.396 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -58.85 -34.66 71.83 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.168 -0.958 . . . . 0.0 110.5 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -69.41 -53.54 18.85 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.227 -0.921 . . . . 0.0 110.78 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.762 HD21 ' CD1' ' A' ' 85' ' ' ILE . 3.3 tt -47.35 -33.66 6.06 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.09 -1.006 . . . . 0.0 110.416 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.486 HG21 ' HG2' ' A' ' 104' ' ' GLN . 44.8 t -77.26 -35.38 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.252 -0.905 . . . . 0.0 110.333 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.19 -49.53 75.7 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -0.91 . . . . 0.0 110.694 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.1 mt -60.93 -56.83 16.52 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.157 -0.965 . . . . 0.0 110.467 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.821 HD11 HD13 ' A' ' 85' ' ' ILE . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.18 -0.95 . . . . 0.0 110.284 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.61 -61.1 1.02 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.204 -1.174 . . . . 0.0 110.219 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 19.6 t -103.76 -28.14 11.83 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.263 -0.898 . . . . 0.0 110.196 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -105.74 173.62 6.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.253 -0.904 . . . . 0.0 110.171 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.66 116.66 18.38 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.162 -0.962 . . . . 0.0 110.291 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.38 132.12 20.4 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.275 -0.891 . . . . 0.0 110.104 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 55.0 m -111.64 -50.25 2.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -0.911 . . . . 0.0 110.309 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -58.89 105.75 0.34 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.211 -0.93 . . . . 0.0 110.272 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 6' ' ' LEU . 1.3 m -59.1 -64.06 1.08 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.274 -0.891 . . . . 0.0 110.199 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.433 ' CB ' ' O ' ' A' ' 5' ' ' SER . 0.6 OUTLIER 64.83 149.7 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.217 -0.927 . . . . 0.0 110.223 179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.82 -83.75 0.65 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.216 -0.928 . . . . 0.0 110.182 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.09 157.93 44.85 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -112.48 167.96 10.03 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.266 -0.896 . . . . 0.0 110.22 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 8.5 mmm -80.79 -157.06 0.15 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.249 -0.907 . . . . 0.0 110.166 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.79 -152.41 0.05 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.192 -0.942 . . . . 0.0 110.185 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.99 -170.49 1.97 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.216 -0.927 . . . . 0.0 110.286 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.2 mm -67.87 134.98 29.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.301 -0.875 . . . . 0.0 110.194 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.9 t -75.38 116.89 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.206 -0.934 . . . . 0.0 110.221 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 20.6 p-80 -63.75 -13.3 42.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.265 -0.897 . . . . 0.0 110.176 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -101.13 77.93 1.86 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 110.209 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -45.76 109.1 0.15 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.255 -0.903 . . . . 0.0 110.117 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.19 66.32 1.34 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.259 -0.901 . . . . 0.0 110.249 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -122.23 19.38 10.67 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.193 -0.942 . . . . 0.0 110.222 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.721 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -68.37 -52.31 34.57 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.237 -0.914 . . . . 0.0 110.309 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.438 ' C ' ' O ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -41.05 -34.03 0.39 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.287 -0.883 . . . . 0.0 110.601 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.1 mm -77.88 -41.86 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.095 -1.003 . . . . 0.0 109.964 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.534 ' HE2' ' CG ' ' A' ' 42' ' ' GLU . 13.3 tptt -61.55 -58.65 7.26 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.253 -0.904 . . . . 0.0 109.934 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.868 HG21 ' HA ' ' A' ' 56' ' ' ILE . 53.7 t -45.45 -55.11 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.407 -0.808 . . . . 0.0 110.385 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.405 ' HG3' ' NH2' ' A' ' 63' ' ' ARG . 18.8 ttt180 -52.69 -63.36 1.17 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.913 . . . . 0.0 110.653 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -14.05 5.44 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.401 -0.812 . . . . 0.0 110.714 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.923 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -86.55 -33.44 20.25 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.134 -0.979 . . . . 0.0 110.328 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.519 ' CA ' ' HB3' ' A' ' 76' ' ' LYS . 19.8 p -91.61 18.74 7.06 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.288 -0.883 . . . . 0.0 110.119 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.462 ' HB2' ' O ' ' A' ' 28' ' ' THR . 20.3 t 178.28 105.68 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.3 -0.875 . . . . 0.0 110.159 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.407 ' O ' ' C ' ' A' ' 31' ' ' ASP . 2.2 t-20 -109.07 37.39 2.58 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.269 -0.894 . . . . 0.0 110.19 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.584 ' CB ' ' CD ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER -44.26 -60.93 2.37 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.2 -0.938 . . . . 0.0 110.224 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.584 ' CD ' ' CB ' ' A' ' 31' ' ' ASP . 24.2 Cg_endo -68.27 -162.9 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.684 0 O-C-N 123.911 1.48 . . . . 0.0 110.301 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 2.4 m95 -112.41 -164.43 0.92 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.227 -0.921 . . . . 0.0 110.6 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 141.03 -167.3 25.72 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -63.81 144.03 87.64 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 O-C-N 124.011 1.532 . . . . 0.0 110.272 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.6 t -129.37 60.86 1.55 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.912 . . . . 0.0 110.344 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -101.74 -71.54 0.71 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.141 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.461 ' HB3' ' HB3' ' A' ' 41' ' ' SER . 0.2 OUTLIER -163.65 67.31 0.18 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.191 -0.943 . . . . 0.0 110.241 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.923 HD23 ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -57.33 -43.87 83.72 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.224 -0.922 . . . . 0.0 110.231 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.405 ' HA ' HD12 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -55.18 -45.02 75.76 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.131 -0.98 . . . . 0.0 110.141 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.461 ' HB3' ' HB3' ' A' ' 38' ' ' SER . 15.6 t -59.72 -29.59 68.22 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.331 -0.855 . . . . 0.0 110.272 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.534 ' CG ' ' HE2' ' A' ' 23' ' ' LYS . 22.0 mm-40 -70.43 -52.06 24.92 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.255 -0.903 . . . . 0.0 110.286 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.774 HD13 ' CD1' ' A' ' 80' ' ' LEU . 7.2 mt -54.24 -35.54 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.183 -0.948 . . . . 0.0 109.992 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.665 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -67.78 -52.21 39.81 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.31 -0.869 . . . . 0.0 109.486 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.485 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 10.8 t0 -53.91 -20.23 5.74 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.087 -1.008 . . . . 0.0 109.187 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.721 HD22 ' HB2' ' A' ' 20' ' ' ALA . 8.5 mt -82.7 -38.11 23.83 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.523 -0.736 . . . . 0.0 110.093 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.532 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 72.3 p -51.82 -42.5 62.56 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.243 -0.911 . . . . 0.0 109.377 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.547 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 86.3 m-85 -43.63 -44.56 6.4 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.712 -0.795 . . . . 0.0 109.259 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.463 ' O ' ' O ' ' A' ' 48' ' ' TYR . 2.4 t-20 -56.68 -157.48 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.865 0.84 . . . . 0.0 110.298 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.6 t -125.97 -34.56 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -178.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.559 HG12 ' N ' ' A' ' 52' ' ' ALA . 11.2 t -84.54 -71.91 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 CA-C-O 121.967 0.889 . . . . 0.0 109.84 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.559 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -37.92 -40.79 0.49 Allowed 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.737 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.653 ' HA ' HD12 ' A' ' 56' ' ' ILE . 8.1 t80 -54.54 -56.4 19.33 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.425 -0.797 . . . . 0.0 110.214 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 58' ' ' SER . 3.5 m -58.87 -34.96 72.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.301 -0.874 . . . . 0.0 110.251 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.65 -20.02 60.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.279 -0.888 . . . . 0.0 110.04 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.868 ' HA ' HG21 ' A' ' 24' ' ' VAL . 36.6 mt -80.96 -70.07 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 110.135 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.5 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 70.5 mmm -52.01 -36.06 48.72 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.25 -0.906 . . . . 0.0 109.909 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 54' ' ' SER . 3.5 m -57.02 -62.69 1.57 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.308 -0.87 . . . . 0.0 110.147 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.05 -25.32 61.06 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 109.894 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.823 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -72.86 -31.34 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.384 -0.823 . . . . 0.0 109.789 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.57 ' CH2' ' SD ' ' A' ' 81' ' ' MET . 14.9 m95 -72.9 -39.84 66.03 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.274 -0.892 . . . . 0.0 110.307 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -58.9 5.81 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.89 . . . . 0.0 110.211 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.405 ' NH2' ' HG3' ' A' ' 25' ' ' ARG . 18.3 mmt180 -63.58 -11.76 27.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.283 -0.885 . . . . 0.0 110.255 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.995 HD22 HD11 ' A' ' 106' ' ' LEU . 4.7 mt -80.17 -24.97 40.0 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.299 -0.876 . . . . 0.0 110.337 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.458 ' O ' ' O ' ' A' ' 66' ' ' ASP . 49.4 t-20 -111.31 42.44 1.67 Allowed 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.352 -0.842 . . . . 0.0 109.949 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.458 ' O ' ' O ' ' A' ' 65' ' ' ASN . 0.1 OUTLIER -52.4 -169.42 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.423 -0.798 . . . . 0.0 110.6 -179.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -86.44 -178.43 6.43 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.458 -0.776 . . . . 0.0 110.277 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -91.17 54.07 3.22 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -144.96 -37.15 0.29 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.374 -1.074 . . . . 0.0 110.293 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -135.68 79.78 1.8 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.233 -0.917 . . . . 0.0 110.303 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.474 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 69.3 p-90 -71.53 -2.95 18.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.311 -0.868 . . . . 0.0 110.178 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -48.21 -45.53 34.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.206 -0.934 . . . . 0.0 109.985 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.408 ' ND1' ' N ' ' A' ' 73' ' ' HIS . 2.8 m-70 -61.64 -36.57 81.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.311 -0.868 . . . . 0.0 109.924 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.68 HG22 ' O ' ' A' ' 64' ' ' LEU . 16.4 t -63.1 -57.24 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.304 -0.873 . . . . 0.0 110.021 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.585 ' CE1' ' HD3' ' A' ' 126' ' ' LYS . 7.0 t80 -49.2 -49.11 44.36 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 109.928 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.519 ' HB3' ' CA ' ' A' ' 28' ' ' THR . 4.5 tptt -62.07 -31.85 72.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.339 -0.851 . . . . 0.0 109.843 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.809 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -69.96 -28.02 65.21 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.349 -0.844 . . . . 0.0 109.908 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.562 ' HG2' HD21 ' A' ' 64' ' ' LEU . 0.7 OUTLIER -73.34 -30.83 63.6 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.387 -0.82 . . . . 0.0 110.183 179.862 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.4 m -70.79 -36.66 73.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.214 -0.929 . . . . 0.0 109.97 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.823 ' CD2' HD11 ' A' ' 60' ' ' ILE . 42.0 tp -77.11 -31.4 55.8 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.318 -0.864 . . . . 0.0 109.677 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.57 ' SD ' ' CH2' ' A' ' 61' ' ' TRP . 31.0 ttp -76.71 -28.12 55.74 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.395 -0.815 . . . . 0.0 109.882 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.548 ' HB2' HD11 ' A' ' 130' ' ' LEU . 26.9 tt0 -85.33 -34.97 21.72 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.262 -0.899 . . . . 0.0 110.026 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.405 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 31.8 t80 -70.58 -45.34 65.57 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.309 -0.87 . . . . 0.0 110.257 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.581 HD11 HG21 ' A' ' 43' ' ' ILE . 50.7 mt -67.46 -40.41 85.36 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.274 -0.892 . . . . 0.0 110.16 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.933 HD13 HD11 ' A' ' 134' ' ' LEU . 26.5 mt -56.75 -20.72 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.197 -0.939 . . . . 0.0 109.973 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 -82.4 0.41 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.24 -0.913 . . . . 0.0 110.013 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.422 HG23 ' HB1' ' A' ' 44' ' ' ALA . 7.6 t -76.6 -25.9 54.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.293 -0.879 . . . . 0.0 110.149 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.665 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -44.24 -69.58 0.69 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.434 ' HB3' ' HG2' ' A' ' 91' ' ' ARG . 0.1 OUTLIER 176.61 176.16 0.31 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.224 -1.162 . . . . 0.0 110.215 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -79.12 -15.18 58.51 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 110.257 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.451 ' HD3' ' O ' ' A' ' 47' ' ' THR . 2.2 ptm180 -82.84 -28.59 30.02 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.132 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.5 HG21 HG21 ' A' ' 47' ' ' THR . 95.0 t -69.25 -31.18 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.198 -0.938 . . . . 0.0 109.628 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 85' ' ' ILE . 74.5 m -78.81 -35.85 43.58 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.308 -0.87 . . . . 0.0 109.623 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.58 -41.11 98.75 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.381 -0.824 . . . . 0.0 109.714 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.21 -35.71 81.9 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.442 -0.786 . . . . 0.0 109.489 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.918 ' SG ' HD13 ' A' ' 134' ' ' LEU . 35.2 t -60.14 -39.8 87.6 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.436 -0.79 . . . . 0.0 109.676 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.37 -33.09 69.24 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.437 -0.789 . . . . 0.0 109.776 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -78.15 -17.73 56.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.389 -0.819 . . . . 0.0 109.903 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -124.45 37.97 4.29 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.46 -0.775 . . . . 0.0 109.928 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -60.19 -29.06 68.46 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.307 -0.871 . . . . 0.0 110.192 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -64.89 -28.06 69.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.274 -0.892 . . . . 0.0 109.899 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.982 ' O ' HG22 ' A' ' 105' ' ' THR . . . -75.68 -42.79 50.21 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.378 -0.826 . . . . 0.0 110.042 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.543 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 3.3 t -71.75 -26.56 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.344 -0.847 . . . . 0.0 110.175 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -85.31 -27.72 25.75 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.329 -0.857 . . . . 0.0 110.311 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.982 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.4 t -56.58 -17.0 7.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.313 -0.867 . . . . 0.0 110.037 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.995 HD11 HD22 ' A' ' 64' ' ' LEU . 17.4 mt -80.12 -40.73 26.87 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.286 -0.884 . . . . 0.0 110.097 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 124' ' ' ARG . 13.6 ttpt -50.49 -30.69 13.44 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.217 -0.927 . . . . 0.0 110.077 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.409 ' OD2' ' HA ' ' A' ' 105' ' ' THR . 2.1 p30 -98.74 -19.23 17.58 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.314 -0.866 . . . . 0.0 110.197 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -59.02 90.24 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.288 -0.883 . . . . 0.0 110.145 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 110' ' ' GLN . 9.1 pt20 -124.65 124.37 42.04 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.357 -0.839 . . . . 0.0 110.131 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -152.95 137.48 16.79 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.214 -0.929 . . . . 0.0 110.273 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.612 ' O ' HG12 ' A' ' 112' ' ' VAL . 47.7 t -138.48 40.76 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.076 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.458 ' HB2' ' O ' ' A' ' 112' ' ' VAL . 11.6 m-20 56.95 172.47 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.319 -0.863 . . . . 0.0 110.224 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -42.95 27.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.224 -0.923 . . . . 0.0 110.311 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -153.12 100.6 2.49 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.272 -0.893 . . . . 0.0 110.108 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -142.91 -149.51 5.14 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.428 ' O ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -111.88 149.75 31.41 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.273 -1.133 . . . . 0.0 110.195 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -81.26 84.66 6.54 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.273 -0.892 . . . . 0.0 110.233 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -118.24 17.26 13.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.261 -0.899 . . . . 0.0 110.212 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.455 ' O ' HG12 ' A' ' 123' ' ' VAL . . . -97.34 31.61 7.57 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.56 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.3 p -89.04 -44.83 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.244 -1.15 . . . . 0.0 110.169 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.56 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.9 OUTLIER -44.41 -37.17 3.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.367 -0.833 . . . . 0.0 109.9 179.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.613 ' CG2' HG12 ' A' ' 74' ' ' VAL . 8.5 p -79.75 -38.01 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.321 -0.862 . . . . 0.0 110.149 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.509 ' N ' HG13 ' A' ' 123' ' ' VAL . 5.1 ttp180 -54.9 -55.41 30.82 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.242 -0.911 . . . . 0.0 110.394 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -67.94 -28.68 67.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.411 -0.806 . . . . 0.0 110.529 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.585 ' HD3' ' CE1' ' A' ' 75' ' ' TYR . 2.3 tptt -60.51 -58.77 7.09 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.179 -0.951 . . . . 0.0 109.899 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.543 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -54.99 -42.67 72.77 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.395 -0.816 . . . . 0.0 110.099 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.67 -35.34 74.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.244 -0.91 . . . . 0.0 110.165 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -65.13 -52.64 54.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.3 -0.875 . . . . 0.0 110.464 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.97 ' O ' HD12 ' A' ' 134' ' ' LEU . 0.1 OUTLIER -48.54 -39.56 23.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.218 -0.926 . . . . 0.0 110.443 -179.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 11.8 t -77.32 -30.8 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.231 -0.918 . . . . 0.0 110.323 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.25 -56.67 12.98 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.204 -0.935 . . . . 0.0 110.172 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.4 mp -58.96 -53.12 61.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.263 -0.898 . . . . 0.0 110.31 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.97 HD12 ' O ' ' A' ' 130' ' ' LEU . 0.8 OUTLIER -55.27 -18.04 5.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.197 -0.939 . . . . 0.0 110.156 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -155.96 88.46 1.11 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.277 -0.89 . . . . 0.0 110.035 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -77.63 -52.15 9.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.219 -0.926 . . . . 0.0 110.521 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -120.93 150.95 40.29 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.193 -0.942 . . . . 0.0 110.343 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -122.71 146.69 47.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.301 -0.874 . . . . 0.0 110.02 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.455 ' O ' ' O ' ' A' ' 140' ' ' LEU . 7.3 mmm180 -93.87 69.91 3.99 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.243 -0.911 . . . . 0.0 110.494 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' A' ' 139' ' ' ARG . 0.1 OUTLIER 55.04 108.97 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.248 -0.908 . . . . 0.0 110.279 179.874 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 5.9 ttt85 -69.67 -162.16 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.221 -0.924 . . . . 0.0 110.221 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -175.25 65.03 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.269 -0.895 . . . . 0.0 110.202 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.61 126.44 55.01 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.284 -0.885 . . . . 0.0 110.152 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.192 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 13.5 t -144.3 48.14 1.38 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.19 -1.183 . . . . 0.0 110.177 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 20.9 m -54.85 149.22 11.74 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.131 -0.98 . . . . 0.0 110.143 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -106.0 121.78 44.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.232 -0.917 . . . . 0.0 110.259 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -110.7 149.52 30.36 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.212 -0.93 . . . . 0.0 110.058 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.63 17.88 14.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.188 -0.945 . . . . 0.0 110.063 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.8 t -58.15 147.04 31.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.231 -0.918 . . . . 0.0 110.254 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.8 m -97.99 9.48 42.68 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.168 -0.957 . . . . 0.0 110.13 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.5 t 49.06 -141.98 0.6 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.298 -0.876 . . . . 0.0 110.185 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.401 ' HA ' HD22 ' A' ' 6' ' ' LEU . 1.6 mm? 53.97 24.01 4.36 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.29 -0.881 . . . . 0.0 110.228 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.469 ' O ' ' HD3' ' A' ' 8' ' ' ARG . 59.8 mtt180 -117.94 -171.92 2.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.278 -0.889 . . . . 0.0 110.272 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.469 ' HD3' ' O ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -152.3 -179.5 7.6 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.245 -0.909 . . . . 0.0 110.243 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.8 mm-40 -100.05 -45.67 5.59 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.242 -0.911 . . . . 0.0 110.23 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.412 ' C ' ' HG3' ' A' ' 11' ' ' LYS . 16.9 mtt -118.88 151.85 37.36 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.189 -0.944 . . . . 0.0 110.166 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.412 ' HG3' ' C ' ' A' ' 10' ' ' MET . 1.8 mttt -135.49 -58.49 0.78 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.268 -0.895 . . . . 0.0 110.305 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -119.52 96.33 5.16 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.25 -0.907 . . . . 0.0 110.206 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 mp -78.64 137.21 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.229 -0.92 . . . . 0.0 110.138 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.4 p -93.63 158.03 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.253 -0.904 . . . . 0.0 110.341 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -73.94 -34.85 64.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.228 -0.92 . . . . 0.0 110.298 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.8 m-20 -126.94 95.75 4.41 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -0.954 . . . . 0.0 110.4 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.526 ' O ' ' CD1' ' A' ' 17' ' ' TYR . 15.1 p90 -55.97 145.85 24.06 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.314 -0.866 . . . . 0.0 110.108 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.438 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 14.5 m -96.16 7.68 45.79 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.163 -0.961 . . . . 0.0 110.257 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 18' ' ' SER . 6.1 mm-40 56.52 16.2 2.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.294 -0.879 . . . . 0.0 110.305 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.752 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -79.13 -48.74 13.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -0.884 . . . . 0.0 110.12 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.498 ' CG ' HG13 ' A' ' 22' ' ' ILE . 9.5 pt-20 -47.51 -32.31 5.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.342 -0.849 . . . . 0.0 110.241 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.498 HG13 ' CG ' ' A' ' 21' ' ' GLU . 28.8 mt -80.25 -43.6 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.258 -0.901 . . . . 0.0 110.172 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.615 ' O ' HD11 ' A' ' 43' ' ' ILE . 5.5 mmtm -57.64 -30.46 65.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.256 -0.902 . . . . 0.0 110.193 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.879 HG22 HD21 ' A' ' 80' ' ' LEU . 44.2 t -77.94 -46.92 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.242 -0.911 . . . . 0.0 110.119 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.85 -39.7 26.68 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.336 -0.852 . . . . 0.0 110.102 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -76.29 -37.96 56.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.398 -0.814 . . . . 0.0 110.121 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 1.024 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -65.49 -13.26 58.44 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.322 -0.861 . . . . 0.0 109.964 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.584 ' HA ' ' CB ' ' A' ' 76' ' ' LYS . 8.5 p -103.8 -28.42 11.64 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.284 -0.885 . . . . 0.0 110.188 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 74.5 m -76.16 -79.51 0.1 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.321 -0.862 . . . . 0.0 110.245 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -168.52 -179.05 3.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.22 -0.925 . . . . 0.0 110.163 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -153.8 146.32 17.44 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.279 -0.888 . . . . 0.0 110.369 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.577 ' O ' ' CE3' ' A' ' 33' ' ' TRP . 18.1 Cg_endo -65.32 -158.65 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 124.091 1.574 . . . . 0.0 110.254 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.577 ' CE3' ' O ' ' A' ' 32' ' ' PRO . 0.5 OUTLIER -144.4 -178.73 6.13 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.204 -0.935 . . . . 0.0 110.674 -179.916 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.61 -111.31 4.17 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -65.54 -165.0 0.07 OUTLIER 'Trans proline' 0 C--N 1.307 -1.64 0 O-C-N 123.862 1.454 . . . . 0.0 110.352 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.6 p -101.08 149.56 23.83 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.225 -0.922 . . . . 0.0 110.329 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -99.77 -28.9 12.92 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.251 -0.905 . . . . 0.0 110.323 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 53.51 63.63 2.14 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.143 -0.973 . . . . 0.0 110.283 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.024 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -119.39 -25.27 6.11 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.191 -0.943 . . . . 0.0 110.212 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.1 ttt -71.95 -60.54 2.18 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.29 -0.882 . . . . 0.0 110.18 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.407 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 82.7 p -53.84 -25.27 18.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.254 -0.904 . . . . 0.0 110.064 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -75.54 -53.17 9.05 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 110.114 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.865 HG21 HD11 ' A' ' 80' ' ' LEU . 59.3 mt -54.71 -35.3 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.297 -0.877 . . . . 0.0 110.134 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.659 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -71.75 -49.98 34.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.221 -0.924 . . . . 0.0 109.548 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.424 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 2.9 m-20 -53.29 -21.13 5.03 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.059 -1.025 . . . . 0.0 108.827 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.792 ' HB3' HD11 ' A' ' 56' ' ' ILE . 14.8 mt -79.25 -38.21 36.12 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.621 -0.674 . . . . 0.0 109.852 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.516 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 72.7 p -51.91 -43.76 63.53 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.103 -0.998 . . . . 0.0 109.156 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.43 ' CE2' ' O ' ' A' ' 87' ' ' THR . 87.5 m-85 -44.67 -42.99 7.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.285 -0.884 . . . . 0.0 109.578 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.543 ' O ' ' C ' ' A' ' 50' ' ' VAL . 14.7 m-20 -72.96 90.65 1.49 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.469 -0.77 . . . . 0.0 110.348 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.543 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.2 -59.04 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.25 178.295 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.535 ' H ' HG23 ' A' ' 50' ' ' VAL . 2.6 t -62.98 -64.17 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.09 -1.006 . . . . 0.0 110.1 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.79 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.81 -47.48 1.02 Allowed 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 121.171 0.51 . . . . 0.0 110.846 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.552 ' CZ ' ' OE1' ' A' ' 95' ' ' GLN . 9.7 t80 -56.36 -54.28 47.4 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.292 -0.88 . . . . 0.0 110.289 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.06 -27.59 54.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.219 -0.926 . . . . 0.0 110.196 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -82.92 -25.31 32.54 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.301 -0.874 . . . . 0.0 110.208 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.792 HD11 ' HB3' ' A' ' 46' ' ' LEU . 8.7 mt -79.21 -69.96 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.361 -0.837 . . . . 0.0 109.945 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.535 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 52.0 mmm -45.85 -37.69 6.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.155 -0.966 . . . . 0.0 109.745 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.3 t -55.19 -61.44 2.33 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.347 -0.845 . . . . 0.0 109.893 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.413 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -59.21 -21.45 59.52 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.153 -0.967 . . . . 0.0 109.859 179.689 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.677 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -76.24 -30.77 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.375 -0.828 . . . . 0.0 109.768 179.781 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 57' ' ' MET . 30.2 m95 -77.51 -51.0 11.45 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.891 . . . . 0.0 110.022 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.98 -51.77 49.41 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.241 -0.912 . . . . 0.0 109.969 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -69.01 -24.25 64.19 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.265 -0.897 . . . . 0.0 110.094 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 1.04 HD22 HD11 ' A' ' 106' ' ' LEU . 4.5 mt -71.07 -25.54 62.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.425 -0.797 . . . . 0.0 110.314 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.447 ' OD1' ' O ' ' A' ' 65' ' ' ASN . 18.1 t-20 -99.66 35.27 2.03 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.307 -0.871 . . . . 0.0 109.89 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.507 ' HB2' HG23 ' A' ' 74' ' ' VAL . 6.2 m-20 -79.15 142.83 36.03 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.415 -0.803 . . . . 0.0 110.159 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.482 ' HB3' ' CZ ' ' A' ' 109' ' ' PHE . 19.0 p80 -161.23 164.3 30.47 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.598 -0.688 . . . . 0.0 110.181 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 91.59 -58.77 2.98 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.29 -88.56 0.09 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.351 -1.088 . . . . 0.0 110.097 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -146.57 143.1 28.63 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.225 -0.922 . . . . 0.0 110.16 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.461 ' CE3' ' HB2' ' A' ' 75' ' ' TYR . 51.7 p-90 -77.11 1.87 16.89 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.321 -0.862 . . . . 0.0 110.227 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' A' ' 71' ' ' TRP . 42.7 mtt-85 -43.18 -41.92 3.96 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.315 -0.866 . . . . 0.0 110.404 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.1 m-70 -68.0 -43.84 77.97 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.107 -0.996 . . . . 0.0 110.248 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.685 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 70.5 t -56.08 -51.49 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.253 -0.904 . . . . 0.0 110.297 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.497 ' HB2' HG23 ' A' ' 123' ' ' VAL . 6.1 t80 -49.78 -64.56 0.77 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.141 -0.974 . . . . 0.0 109.975 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.584 ' CB ' ' HA ' ' A' ' 28' ' ' THR . 1.1 mmpt? -55.21 -21.7 14.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.327 -0.858 . . . . 0.0 110.044 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.907 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -69.79 -37.97 76.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.182 -0.949 . . . . 0.0 110.186 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.715 ' HE1' HG22 ' A' ' 123' ' ' VAL . 2.8 mpp? -68.39 -41.67 80.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.361 -0.837 . . . . 0.0 110.195 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.6 m -58.41 -45.99 87.3 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -0.889 . . . . 0.0 110.399 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.879 HD21 HG22 ' A' ' 24' ' ' VAL . 18.2 tp -58.45 -60.27 4.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.268 -0.895 . . . . 0.0 109.926 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.442 ' O ' HG13 ' A' ' 85' ' ' ILE . 28.1 ttm -53.78 -21.97 8.45 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.204 -0.935 . . . . 0.0 110.101 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.447 ' N ' HD11 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -79.89 -37.89 33.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.236 -0.915 . . . . 0.0 110.716 -179.751 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.722 ' O ' HG22 ' A' ' 87' ' ' THR . 32.3 t80 -81.0 -22.66 39.25 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.238 -0.914 . . . . 0.0 110.784 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.728 ' HB2' HG11 ' A' ' 92' ' ' VAL . 48.2 mt -85.17 -21.44 29.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.206 -0.934 . . . . 0.0 110.075 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.998 HG21 HD11 ' A' ' 134' ' ' LEU . 33.2 mt -76.64 -13.98 14.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.316 -0.865 . . . . 0.0 109.553 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -105.39 -48.02 3.8 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.382 -0.824 . . . . 0.0 110.044 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.722 HG22 ' O ' ' A' ' 83' ' ' TYR . 7.6 t -114.48 -2.72 13.12 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.272 -0.892 . . . . 0.0 110.168 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.614 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -89.88 34.88 3.92 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.548 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 2.5 t 74.28 150.14 0.11 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.447 -1.031 . . . . 0.0 110.157 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -65.18 -7.93 14.92 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.354 -0.841 . . . . 0.0 110.598 -179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -72.1 -38.47 69.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.111 -0.993 . . . . 0.0 109.732 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.728 HG11 ' HB2' ' A' ' 84' ' ' LEU . 84.0 t -60.08 -28.92 42.52 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 O-C-N 121.372 -0.83 . . . . 0.0 109.937 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.517 ' CB ' HG23 ' A' ' 85' ' ' ILE . 10.3 p -83.57 -38.92 21.03 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.283 -0.886 . . . . 0.0 109.982 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -58.03 -57.89 10.83 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.228 -0.92 . . . . 0.0 109.694 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.552 ' OE1' ' CZ ' ' A' ' 53' ' ' PHE . 34.8 tt0 -52.79 -35.7 57.09 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.454 -0.778 . . . . 0.0 109.448 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.416 ' SG ' HD11 ' A' ' 85' ' ' ILE . 1.7 t -55.41 -44.23 76.01 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 109.563 179.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -66.0 -46.81 76.65 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.497 -0.752 . . . . 0.0 109.747 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -65.01 -16.12 63.08 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.408 -0.807 . . . . 0.0 109.797 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.5 32.81 4.95 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.366 -0.834 . . . . 0.0 109.844 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.1 mtp -61.63 -28.26 69.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.298 -0.876 . . . . 0.0 110.224 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.476 ' O ' ' HB ' ' A' ' 105' ' ' THR . 15.6 m-85 -66.84 -24.97 66.21 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.236 -0.915 . . . . 0.0 109.934 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.951 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.59 -40.88 48.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.885 . . . . 0.0 110.008 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.538 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.9 t -75.06 -27.04 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.351 -0.843 . . . . 0.0 109.903 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.704 HE21 HG11 ' A' ' 131' ' ' VAL . 95.7 mt-30 -85.7 -28.24 24.79 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.411 -0.806 . . . . 0.0 109.985 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.4 t -53.44 -24.79 13.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.903 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 1.04 HD11 HD22 ' A' ' 64' ' ' LEU . 42.0 mt -70.53 -38.48 74.25 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.392 -0.818 . . . . 0.0 109.955 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.578 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 14.4 ttpt -55.6 -24.81 35.1 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.245 -0.909 . . . . 0.0 109.888 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.411 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 0.9 OUTLIER -106.16 -18.99 13.85 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.29 -0.881 . . . . 0.0 110.131 179.899 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.482 ' CZ ' ' HB3' ' A' ' 67' ' ' HIS . 5.4 t80 -60.01 95.43 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.231 -0.918 . . . . 0.0 110.099 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 2.8 mt-30 -119.5 146.63 45.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.327 -0.858 . . . . 0.0 110.164 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -166.73 100.49 0.57 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.205 -0.935 . . . . 0.0 110.218 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.597 ' O ' HG13 ' A' ' 112' ' ' VAL . 3.4 p -124.85 35.23 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.219 -0.926 . . . . 0.0 110.328 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.462 ' CB ' ' O ' ' A' ' 112' ' ' VAL . 0.4 OUTLIER 67.59 -174.86 0.19 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.166 -0.959 . . . . 0.0 110.231 179.937 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.58 -48.47 63.15 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.202 -0.936 . . . . 0.0 110.306 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -149.77 137.71 20.3 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.241 -0.912 . . . . 0.0 110.257 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 177.43 -154.28 15.23 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 118' ' ' ASP . 0.8 OUTLIER -121.17 109.36 14.9 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.328 -1.101 . . . . 0.0 110.082 -179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.411 ' C ' ' O ' ' A' ' 117' ' ' LYS . 11.9 t0 -43.59 99.63 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.262 -0.899 . . . . 0.0 110.27 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.41 ' N ' ' O ' ' A' ' 117' ' ' LYS . 0.1 OUTLIER -100.36 -9.57 22.12 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.219 -0.925 . . . . 0.0 110.4 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -88.92 57.08 4.06 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.555 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.1 p -90.59 -44.34 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.273 -1.134 . . . . 0.0 110.353 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.555 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.2 m-80 -40.91 -46.94 2.89 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.482 -0.761 . . . . 0.0 110.271 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.715 HG22 ' HE1' ' A' ' 78' ' ' MET . 0.9 OUTLIER -66.33 -42.92 91.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.319 -0.863 . . . . 0.0 109.867 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.578 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -56.87 -67.85 0.27 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.188 -0.945 . . . . 0.0 111.063 -179.554 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.18 -35.95 76.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.284 -0.885 . . . . 0.0 111.331 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 0.0 OUTLIER -57.56 -54.14 50.2 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.111 -0.993 . . . . 0.0 110.446 -179.561 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.538 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -57.25 -40.8 78.35 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.38 -0.825 . . . . 0.0 110.068 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt -62.5 -33.72 75.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.183 -0.948 . . . . 0.0 110.241 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -62.71 -40.27 96.63 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.287 -0.883 . . . . 0.0 110.586 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.903 HD21 ' CD1' ' A' ' 85' ' ' ILE . 0.6 OUTLIER -62.5 -53.05 60.44 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.248 -0.907 . . . . 0.0 110.569 -179.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.704 HG11 HE21 ' A' ' 104' ' ' GLN . 25.3 t -65.84 -25.68 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.408 -0.807 . . . . 0.0 110.413 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 135' ' ' ARG . . . -65.92 -55.55 16.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.25 -0.906 . . . . 0.0 110.509 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.85 -56.94 15.17 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.137 -0.977 . . . . 0.0 110.307 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.998 HD11 HG21 ' A' ' 85' ' ' ILE . 3.0 mp -46.34 -52.37 12.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.23 -0.919 . . . . 0.0 110.136 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 132' ' ' ALA . 4.4 tpt180 -99.87 117.38 34.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.245 -0.91 . . . . 0.0 110.075 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -146.16 -38.32 0.24 Allowed 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.203 -0.935 . . . . 0.0 110.43 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -109.44 166.93 10.5 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.152 -0.968 . . . . 0.0 110.265 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.64 125.65 12.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.314 -0.866 . . . . 0.0 110.291 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -68.14 0.19 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 0.0 110.219 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.73 178.23 0.12 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.276 -0.89 . . . . 0.0 110.251 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -120.94 -18.32 7.6 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.25 -0.906 . . . . 0.0 110.139 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -103.17 -164.75 1.1 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.272 -0.892 . . . . 0.0 110.262 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -164.57 41.21 0.08 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 40.0 mtt180 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.207 179.992 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.76 -17.33 24.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.328 -1.101 . . . . 0.0 110.15 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 59.8 p -61.15 -158.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.21 -0.932 . . . . 0.0 110.16 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . 0.616 ' O ' HG23 ' A' ' 3' ' ' THR . 40.2 mtm-85 -100.99 15.93 27.04 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.234 -0.916 . . . . 0.0 110.208 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.401 ' O ' ' C ' ' A' ' 2' ' ' SER . 32.3 mmm 50.91 30.14 4.99 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.181 -0.949 . . . . 0.0 110.266 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.401 ' C ' ' O ' ' A' ' 1' ' ' MET . 41.8 t 44.71 61.49 2.44 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.182 -0.949 . . . . 0.0 110.217 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.616 HG23 ' O ' ' A' ' 0' ' ' ARG . 47.0 p -56.45 -27.3 56.41 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.212 -0.93 . . . . 0.0 110.268 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 54.96 40.41 32.0 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.266 -0.896 . . . . 0.0 110.198 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.9 t 52.63 -171.49 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.262 -0.899 . . . . 0.0 110.254 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -145.98 128.36 15.9 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.175 -0.953 . . . . 0.0 110.232 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -80.16 152.57 29.14 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.28 -0.887 . . . . 0.0 110.24 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.418 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 0.0 OUTLIER -117.38 149.53 40.37 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.235 -0.915 . . . . 0.0 110.266 -179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -149.87 132.78 16.1 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.224 -0.922 . . . . 0.0 110.211 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.8 mtt -132.41 -145.76 0.27 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.292 -0.88 . . . . 0.0 110.261 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.7 mtmp? -75.06 -56.91 4.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 110.295 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.1 m120 49.06 32.83 4.22 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.213 -0.929 . . . . 0.0 110.181 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 tt -98.16 -23.66 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.273 -0.892 . . . . 0.0 110.184 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.3 t -70.63 94.59 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.26 -0.9 . . . . 0.0 110.155 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -94.15 92.26 7.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.282 -0.887 . . . . 0.0 110.259 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -130.8 16.81 5.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.231 -0.918 . . . . 0.0 110.176 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.514 ' O ' ' CD1' ' A' ' 17' ' ' TYR . 41.1 p90 -80.63 136.25 36.19 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.889 . . . . 0.0 110.184 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.45 ' O ' ' HB3' ' A' ' 19' ' ' GLU . 30.7 t -111.17 -45.48 3.42 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.29 -0.881 . . . . 0.0 110.125 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 1.002 ' HB2' HD12 ' A' ' 22' ' ' ILE . 0.1 OUTLIER 175.26 48.69 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.25 -0.906 . . . . 0.0 110.23 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.987 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -64.89 -56.8 11.17 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 110.216 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' A' ' 20' ' ' ALA . 18.8 pt-20 -42.96 -28.52 0.26 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.255 -0.903 . . . . 0.0 110.039 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 1.002 HD12 ' HB2' ' A' ' 19' ' ' GLU . 40.8 mt -74.19 -57.65 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.314 -0.866 . . . . 0.0 110.037 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.491 ' CB ' HG12 ' A' ' 43' ' ' ILE . 1.8 mmpt? -48.09 -51.05 26.14 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.351 -0.843 . . . . 0.0 110.214 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.943 HG13 ' CD2' ' A' ' 80' ' ' LEU . 20.0 t -56.28 -36.28 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.286 -0.884 . . . . 0.0 110.207 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.4 ttt85 -67.05 -38.14 85.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.2 -0.937 . . . . 0.0 110.177 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -81.18 -14.75 57.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.265 -0.897 . . . . 0.0 109.966 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.811 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -77.72 -20.29 53.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.867 . . . . 0.0 110.244 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.467 HG22 ' HB3' ' A' ' 76' ' ' LYS . 30.2 p -126.01 61.9 1.26 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.226 -0.921 . . . . 0.0 110.251 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.47 ' O ' ' OG ' ' A' ' 29' ' ' SER . 3.2 p -179.6 106.42 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 0.0 110.17 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -83.99 0.65 47.17 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.256 -0.902 . . . . 0.0 110.241 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.569 ' CB ' ' CD ' ' A' ' 32' ' ' PRO . 0.5 OUTLIER -52.95 -60.12 7.4 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.315 -0.866 . . . . 0.0 110.289 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.569 ' CD ' ' CB ' ' A' ' 31' ' ' ASP . 19.5 Cg_endo -64.57 -176.54 0.43 Allowed 'Trans proline' 0 C--N 1.306 -1.706 0 O-C-N 123.947 1.499 . . . . 0.0 110.321 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.406 ' C ' ' O ' ' A' ' 32' ' ' PRO . 1.0 OUTLIER -43.09 -87.15 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.276 -0.89 . . . . 0.0 110.644 -179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 175.06 -167.69 39.91 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -57.98 150.79 61.95 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 O-C-N 124.054 1.555 . . . . 0.0 110.498 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.2 m -142.61 125.32 15.93 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.265 -0.897 . . . . 0.0 110.13 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.4 t 48.98 48.42 20.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.282 -0.886 . . . . 0.0 110.199 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 t 58.06 100.73 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.299 -0.875 . . . . 0.0 110.149 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.811 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.6 OUTLIER -89.2 -9.55 50.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.345 -0.847 . . . . 0.0 110.263 -179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.573 ' CE ' HG22 ' A' ' 79' ' ' THR . 6.9 mmm -84.79 -45.79 12.01 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.186 -0.946 . . . . 0.0 110.207 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.408 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.2 OUTLIER -63.97 -29.34 70.51 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.355 -0.84 . . . . 0.0 110.277 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -72.77 -49.64 29.55 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.938 . . . . 0.0 110.102 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.799 HG21 HD11 ' A' ' 80' ' ' LEU . 44.7 mt -55.91 -33.87 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.273 -0.892 . . . . 0.0 110.022 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.64 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -71.63 -52.9 15.56 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.236 -0.915 . . . . 0.0 109.401 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.478 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 7.4 t70 -51.82 -22.38 3.63 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.059 -1.025 . . . . 0.0 108.742 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.987 HD22 ' HB2' ' A' ' 20' ' ' ALA . 8.1 mt -78.24 -40.03 38.47 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.611 -0.681 . . . . 0.0 110.017 179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.525 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 73.1 p -49.69 -42.0 44.64 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.11 -0.994 . . . . 0.0 109.159 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.561 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 83.7 m-85 -45.52 -46.27 13.85 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.234 -0.916 . . . . 0.0 109.367 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 50' ' ' VAL . 22.7 m-20 -71.14 89.65 0.85 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.529 -0.732 . . . . 0.0 110.358 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.73 -57.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.561 178.228 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.54 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -63.07 -65.9 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.04 -1.037 . . . . 0.0 110.069 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -38.16 -42.43 0.67 Allowed 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.305 0.574 . . . . 0.0 110.602 -177.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.525 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 10.0 t80 -59.56 -53.65 55.67 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.376 -0.828 . . . . 0.0 109.952 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -30.36 62.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.28 -0.887 . . . . 0.0 109.745 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.68 -25.67 41.18 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.307 -0.871 . . . . 0.0 110.178 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.863 ' HA ' HG21 ' A' ' 24' ' ' VAL . 6.9 mt -77.59 -70.18 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.324 -0.86 . . . . 0.0 110.283 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.497 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 91.6 mmm -47.75 -36.31 11.27 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.21 -0.931 . . . . 0.0 109.91 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 t -55.21 -60.67 3.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.377 -0.827 . . . . 0.0 109.971 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.27 -25.6 65.83 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.175 -0.953 . . . . 0.0 109.687 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.647 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.5 OUTLIER -71.1 -29.59 37.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.379 -0.825 . . . . 0.0 109.506 179.641 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.477 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 13.4 m95 -78.21 -41.04 35.69 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.239 -0.913 . . . . 0.0 109.964 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.78 -53.03 53.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.329 -0.857 . . . . 0.0 109.964 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.488 ' HB3' ' HB3' ' A' ' 73' ' ' HIS . 4.0 mmt180 -70.06 -33.83 72.43 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.381 -0.824 . . . . 0.0 109.992 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.941 HD22 HD11 ' A' ' 106' ' ' LEU . 11.8 mt -65.11 -9.45 22.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.447 -0.783 . . . . 0.0 110.357 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.451 ' O ' ' C ' ' A' ' 66' ' ' ASP . 1.4 m-20 -87.83 31.51 0.77 Allowed 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.307 -0.87 . . . . 0.0 110.156 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.579 ' HB2' ' CZ ' ' A' ' 109' ' ' PHE . 4.4 p30 37.28 -158.36 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 121.805 0.812 . . . . 0.0 110.801 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.422 ' CB ' ' O ' ' A' ' 66' ' ' ASP . 0.1 OUTLIER 172.92 -155.41 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.636 -0.665 . . . . 0.0 109.977 -179.814 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -66.53 -100.68 0.02 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.17 43.31 1.29 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.256 -1.144 . . . . 0.0 110.288 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -129.71 41.81 3.38 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.325 -0.859 . . . . 0.0 110.409 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.455 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 35.7 p-90 -62.62 -13.24 29.41 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.198 -0.939 . . . . 0.0 110.048 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -52.56 -39.59 61.66 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.392 -0.817 . . . . 0.0 110.287 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.488 ' HB3' ' HB3' ' A' ' 63' ' ' ARG . 5.0 m-70 -61.99 -36.81 82.6 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.207 -0.933 . . . . 0.0 110.111 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.813 HG12 HG22 ' A' ' 123' ' ' VAL . 24.5 t -59.06 -54.54 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.31 -0.869 . . . . 0.0 110.125 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.461 ' HA ' ' HE1' ' A' ' 78' ' ' MET . 22.7 t80 -49.91 -56.45 10.5 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.183 -0.948 . . . . 0.0 109.995 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.467 ' HB3' HG22 ' A' ' 28' ' ' THR . 0.0 OUTLIER -59.74 -25.81 65.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.352 -0.843 . . . . 0.0 110.036 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.793 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -73.12 -27.43 61.68 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.317 -0.864 . . . . 0.0 110.038 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.643 ' SD ' HD13 ' A' ' 106' ' ' LEU . 1.5 mpp? -74.76 -32.96 62.21 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.327 -0.858 . . . . 0.0 109.991 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.573 HG22 ' CE ' ' A' ' 40' ' ' MET . 35.9 m -74.69 -27.74 60.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.399 -0.813 . . . . 0.0 110.283 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.943 ' CD2' HG13 ' A' ' 24' ' ' VAL . 19.5 tp -76.09 -53.49 8.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.161 -0.962 . . . . 0.0 109.378 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.808 ' HE2' HD11 ' A' ' 64' ' ' LEU . 6.5 ttp -61.39 -20.62 63.24 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.158 -0.964 . . . . 0.0 109.724 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.576 ' CB ' HD13 ' A' ' 130' ' ' LEU . 13.4 tm-20 -88.36 -33.49 17.93 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.167 -0.958 . . . . 0.0 110.354 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.49 ' O ' HG22 ' A' ' 87' ' ' THR . 10.5 t80 -79.87 -21.92 43.48 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.269 -0.894 . . . . 0.0 110.467 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.581 HD13 HG21 ' A' ' 56' ' ' ILE . 68.5 mt -88.86 -34.74 16.89 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.261 -0.899 . . . . 0.0 110.021 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.813 HD12 HD11 ' A' ' 130' ' ' LEU . 37.5 mt -56.95 -22.95 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.061 -1.024 . . . . 0.0 109.972 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -95.24 -80.49 0.41 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.233 -0.917 . . . . 0.0 110.284 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.64 HG23 ' HB1' ' A' ' 44' ' ' ALA . 7.9 t -75.65 -24.44 56.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.254 -0.904 . . . . 0.0 110.319 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.561 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -49.34 -77.29 0.13 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.0 t 177.09 154.16 0.24 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.251 -1.146 . . . . 0.0 110.31 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.47 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 1.6 mt-10 -55.92 -17.19 5.91 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.902 . . . . 0.0 110.303 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -77.02 -38.02 53.81 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.181 -0.949 . . . . 0.0 110.11 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.486 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 73.1 t -59.67 -38.96 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.213 -0.929 . . . . 0.0 110.084 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.91 -40.24 72.28 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.881 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 90' ' ' GLU . 5.6 mt-30 -60.72 -39.77 89.81 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.229 -0.919 . . . . 0.0 109.994 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.441 ' HA ' ' OE1' ' A' ' 95' ' ' GLN . 3.5 tp60 -65.07 -39.59 93.46 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.321 -0.862 . . . . 0.0 109.259 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.814 ' HB3' HD13 ' A' ' 134' ' ' LEU . 2.8 m -56.2 -41.31 75.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.341 -0.849 . . . . 0.0 109.503 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 22.0 mtmt -67.56 -32.46 73.25 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.497 -0.752 . . . . 0.0 109.441 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -80.31 -14.32 58.47 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.411 -0.805 . . . . 0.0 109.68 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -129.86 33.4 4.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.452 -0.78 . . . . 0.0 110.08 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.459 ' HE3' ' CZ ' ' A' ' 101' ' ' TYR . 8.4 ptt? -60.74 -28.94 69.07 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.247 -0.908 . . . . 0.0 110.252 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.459 ' CZ ' ' HE3' ' A' ' 100' ' ' MET . 41.5 m-85 -65.61 -26.4 67.81 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.337 -0.852 . . . . 0.0 110.198 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.969 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.65 -41.4 45.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 110.133 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.429 HG23 ' H ' ' A' ' 103' ' ' VAL . 2.5 t -73.2 -25.85 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.324 -0.86 . . . . 0.0 109.989 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -87.65 -24.82 23.8 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.287 -0.883 . . . . 0.0 110.452 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.969 HG22 ' O ' ' A' ' 102' ' ' ALA . 12.0 t -63.59 -12.61 34.57 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.186 -0.946 . . . . 0.0 110.368 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.941 HD11 HD22 ' A' ' 64' ' ' LEU . 17.4 mt -73.86 -40.05 63.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.189 -0.944 . . . . 0.0 110.219 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.473 ' HG3' ' N ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -49.17 -24.84 1.86 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.161 -0.962 . . . . 0.0 110.025 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.473 ' N ' ' HG3' ' A' ' 107' ' ' LYS . 10.8 t0 -93.72 -31.44 14.43 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.269 -0.894 . . . . 0.0 110.249 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.579 ' CZ ' ' HB2' ' A' ' 66' ' ' ASP . 1.3 t80 -49.09 115.13 1.18 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.188 -0.945 . . . . 0.0 110.223 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.471 ' CG ' ' O ' ' A' ' 110' ' ' GLN . 10.7 pt20 -154.1 120.13 5.33 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.325 -0.859 . . . . 0.0 109.902 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.493 ' CD1' ' C ' ' A' ' 111' ' ' TYR . 1.5 t80 -168.52 113.21 0.61 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.253 -0.904 . . . . 0.0 110.263 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.659 HG12 ' N ' ' A' ' 113' ' ' ASP . 73.7 t -88.29 -100.61 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.26 -0.9 . . . . 0.0 110.019 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.659 ' N ' HG12 ' A' ' 112' ' ' VAL . 0.2 OUTLIER -153.78 -165.92 2.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.081 -1.012 . . . . 0.0 110.106 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 18.7 ptt-85 -46.47 -46.48 18.98 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.262 -0.898 . . . . 0.0 109.888 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -154.94 40.69 0.44 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.463 -0.773 . . . . 0.0 110.049 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.521 ' C ' HG11 ' A' ' 112' ' ' VAL . . . -81.53 -158.55 21.57 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.496 ' N ' HG11 ' A' ' 112' ' ' VAL . 73.8 tttt -122.91 138.26 54.72 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.321 -1.106 . . . . 0.0 110.297 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.518 ' HA ' ' CG2' ' A' ' 112' ' ' VAL . 6.0 t0 -47.55 112.94 0.61 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.315 -0.866 . . . . 0.0 110.072 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -143.12 39.29 1.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.243 -0.91 . . . . 0.0 110.346 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -127.53 38.98 2.01 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.561 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.9 p -82.51 -43.64 19.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.222 -1.164 . . . . 0.0 110.26 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.561 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 2.6 t30 -40.56 -27.68 0.05 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.595 -0.69 . . . . 0.0 110.257 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.813 HG22 HG12 ' A' ' 74' ' ' VAL . 2.0 t -76.74 -49.23 24.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.245 -0.909 . . . . 0.0 109.968 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -60.34 -36.8 78.81 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.116 -0.99 . . . . 0.0 110.802 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -77.93 -61.41 2.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.183 -0.948 . . . . 0.0 110.88 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.8 tptp -48.65 -44.52 37.62 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.151 -0.968 . . . . 0.0 110.268 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.504 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -65.38 -44.14 88.49 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.298 -0.876 . . . . 0.0 110.411 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -49.79 -39.13 37.12 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.186 -0.946 . . . . 0.0 110.505 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -71.31 -50.95 27.31 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.221 -0.924 . . . . 0.0 110.438 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.813 HD11 HD12 ' A' ' 85' ' ' ILE . 11.9 tp -49.48 -22.31 1.17 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.247 -0.908 . . . . 0.0 110.317 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 127' ' ' ALA . 42.8 t -92.19 -31.76 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 110.304 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.408 ' O ' ' C ' ' A' ' 133' ' ' LEU . . . -70.37 -63.13 1.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.318 -0.864 . . . . 0.0 110.302 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.408 ' C ' ' O ' ' A' ' 132' ' ' ALA . 13.2 tp -43.53 -27.42 0.29 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.228 -0.92 . . . . 0.0 110.351 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.814 HD13 ' HB3' ' A' ' 96' ' ' CYS . 20.5 mt -77.9 -57.5 3.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.914 . . . . 0.0 110.335 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -105.26 54.93 0.7 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.167 -0.958 . . . . 0.0 110.196 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -81.9 -67.7 0.76 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.342 -0.849 . . . . 0.0 110.292 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -100.0 168.8 9.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.221 -0.924 . . . . 0.0 110.292 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -143.52 164.44 30.35 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.14 -0.975 . . . . 0.0 110.328 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.407 ' O ' ' C ' ' A' ' 140' ' ' LEU . 10.0 mtm180 -51.95 -84.14 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.27 -0.894 . . . . 0.0 110.324 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.407 ' C ' ' O ' ' A' ' 139' ' ' ARG . 0.9 OUTLIER 43.58 78.07 0.06 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.194 -0.941 . . . . 0.0 110.162 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -56.61 143.97 33.81 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.294 -0.879 . . . . 0.0 110.433 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.454 ' CG ' ' O ' ' A' ' 142' ' ' GLU . 0.1 OUTLIER -79.34 95.51 5.73 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.377 -0.827 . . . . 0.0 110.078 179.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -51.33 116.83 2.24 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.283 -0.885 . . . . 0.0 110.261 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.193 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -136.07 127.9 29.26 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.337 -1.096 . . . . 0.0 110.095 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.71 76.92 0.45 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 110.211 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -115.31 -177.71 3.2 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.257 -0.902 . . . . 0.0 110.196 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -103.89 -5.1 22.65 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.278 -0.889 . . . . 0.0 110.167 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.46 138.52 3.02 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.169 -0.957 . . . . 0.0 110.252 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.4 p -117.78 9.99 13.15 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.295 -0.878 . . . . 0.0 110.264 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.03 39.13 3.6 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.208 -0.932 . . . . 0.0 110.228 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -172.11 2.08 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.292 -0.88 . . . . 0.0 110.224 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.44 170.65 8.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.258 -0.901 . . . . 0.0 110.102 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.4 mtt85 -118.31 7.95 12.13 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.217 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.5 mmt-85 -59.18 143.1 49.92 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.361 -0.837 . . . . 0.0 110.258 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -139.73 80.14 1.75 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.254 -0.904 . . . . 0.0 110.186 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -97.59 -28.38 13.96 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.16 153.85 6.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.221 -0.925 . . . . 0.0 110.252 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.439 ' O ' ' HB ' ' A' ' 13' ' ' ILE . 18.0 p-10 -149.47 55.78 0.97 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.404 -0.81 . . . . 0.0 110.134 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.439 ' HB ' ' O ' ' A' ' 12' ' ' ASN . 19.5 mt 60.5 164.74 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.237 -0.914 . . . . 0.0 110.168 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.9 m -139.12 114.9 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.263 -0.898 . . . . 0.0 110.287 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -98.61 -155.31 0.49 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 110.341 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.473 ' OD1' HG21 ' A' ' 51' ' ' VAL . 34.6 t-20 -70.04 -32.6 70.8 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.297 -0.877 . . . . 0.0 110.329 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -74.28 140.14 44.74 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.219 -0.926 . . . . 0.0 110.286 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -117.57 7.38 12.64 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.211 -0.93 . . . . 0.0 110.14 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.451 ' O ' ' HB ' ' A' ' 22' ' ' ILE . 4.5 mt-10 54.52 21.65 3.47 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.294 -0.879 . . . . 0.0 110.344 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.851 ' HB2' HD13 ' A' ' 46' ' ' LEU . . . -57.19 -50.45 72.8 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.918 . . . . 0.0 110.095 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 1.2 pt-20 -48.52 -28.06 3.12 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.203 -0.936 . . . . 0.0 109.897 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.451 ' HB ' ' O ' ' A' ' 19' ' ' GLU . 49.3 mm -73.29 -41.47 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.295 -0.878 . . . . 0.0 109.904 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.473 ' CB ' HG12 ' A' ' 43' ' ' ILE . 11.6 mmtt -64.56 -42.75 95.47 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.253 -0.904 . . . . 0.0 109.907 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 1.036 HG22 HD21 ' A' ' 80' ' ' LEU . 14.8 t -64.81 -30.65 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.264 -0.897 . . . . 0.0 110.03 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -62.34 -42.69 99.59 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.201 -0.937 . . . . 0.0 110.04 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -83.44 -19.88 35.12 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.48 -0.763 . . . . 0.0 110.108 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.872 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -81.25 -14.16 57.74 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.307 -0.87 . . . . 0.0 110.25 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.492 ' O ' ' HB3' ' A' ' 76' ' ' LYS . 3.8 p -103.09 7.36 38.86 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.24 -0.912 . . . . 0.0 110.292 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 36.1 t -85.78 -80.7 0.22 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.141 -0.974 . . . . 0.0 110.198 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.417 ' O ' ' CB ' ' A' ' 31' ' ' ASP . 1.1 t-20 178.73 -58.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.302 -0.873 . . . . 0.0 109.976 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.417 ' CB ' ' O ' ' A' ' 30' ' ' ASN . 0.1 OUTLIER 64.23 89.23 0.11 Allowed Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.346 -0.846 . . . . 0.0 110.332 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 31' ' ' ASP . 13.4 Cg_endo -61.86 -168.28 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.035 1.545 . . . . 0.0 110.167 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.407 ' O ' ' O ' ' A' ' 34' ' ' GLY . 0.5 OUTLIER 57.52 173.04 0.05 OUTLIER 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.268 -0.895 . . . . 0.0 110.473 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.407 ' O ' ' O ' ' A' ' 33' ' ' TRP . . . -58.09 -164.23 0.07 OUTLIER Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.423 ' O ' ' O ' ' A' ' 36' ' ' SER . 18.4 Cg_endo -65.06 -76.75 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.77 0 O-C-N 123.985 1.519 . . . . 0.0 110.292 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 35' ' ' PRO . 1.3 m 61.57 136.05 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.31 -0.869 . . . . 0.0 110.238 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 63.28 167.69 0.14 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.906 . . . . 0.0 110.239 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.9 t -129.1 101.58 6.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.312 -0.868 . . . . 0.0 110.039 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.872 HD21 ' HB2' ' A' ' 27' ' ' ALA . 1.9 tp -109.72 -45.76 3.61 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.282 -0.886 . . . . 0.0 110.369 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -44.45 77.17 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.266 -0.896 . . . . 0.0 110.497 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.411 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.1 OUTLIER -66.5 -28.25 68.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.171 -0.956 . . . . 0.0 110.589 -179.767 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -72.68 -47.73 44.97 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.203 -0.936 . . . . 0.0 110.257 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.648 HG23 HG12 ' A' ' 56' ' ' ILE . 62.6 mt -57.25 -36.09 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.177 -0.952 . . . . 0.0 110.029 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.725 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.33 -49.84 45.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.174 -0.954 . . . . 0.0 109.522 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -51.25 -22.27 2.61 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.029 -1.044 . . . . 0.0 108.831 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.851 HD13 ' HB2' ' A' ' 20' ' ' ALA . 12.4 mt -81.99 -37.99 25.79 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.623 -0.673 . . . . 0.0 110.245 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.573 HG21 HG21 ' A' ' 92' ' ' VAL . 71.8 p -50.51 -40.53 51.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.111 -0.993 . . . . 0.0 109.474 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 49' ' ' ASN . 66.9 m-85 -44.61 -46.75 10.23 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 119.624 -0.83 . . . . 0.0 109.122 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.473 ' O ' ' O ' ' A' ' 48' ' ' TYR . 0.8 OUTLIER -55.62 -158.76 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 CA-C-O 121.98 0.895 . . . . 0.0 110.498 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.428 ' CG2' ' N ' ' A' ' 51' ' ' VAL . 3.1 m -125.5 -34.67 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -178.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.541 HG12 ' N ' ' A' ' 52' ' ' ALA . 8.5 t -82.88 -70.64 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 CA-C-O 122.07 0.938 . . . . 0.0 109.618 178.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.665 ' HB1' ' HB2' ' A' ' 20' ' ' ALA . . . -40.37 -41.58 1.4 Allowed 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.247 -178.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.543 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 12.6 t80 -56.2 -52.6 63.84 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.471 -0.768 . . . . 0.0 109.861 179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 58' ' ' SER . 40.9 t -60.49 -26.86 67.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.316 -0.865 . . . . 0.0 109.643 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 1.7 mm-40 -81.45 -21.56 38.74 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.47 -0.769 . . . . 0.0 109.782 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.648 HG12 HG23 ' A' ' 43' ' ' ILE . 7.7 mt -81.78 -70.12 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.328 -0.857 . . . . 0.0 109.851 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.418 ' HA ' ' HB ' ' A' ' 60' ' ' ILE . 79.8 mmm -49.73 -36.68 26.42 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.31 -0.869 . . . . 0.0 109.73 179.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 54' ' ' SER . 2.2 m -55.83 -60.41 3.5 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.316 -0.865 . . . . 0.0 109.696 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.406 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.5 OUTLIER -59.38 -23.84 62.93 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.253 -0.904 . . . . 0.0 109.674 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.547 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -71.64 -33.14 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.427 -0.796 . . . . 0.0 109.569 179.776 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.422 ' CH2' ' CE ' ' A' ' 81' ' ' MET . 28.2 m95 -77.91 -31.35 51.12 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.212 -0.93 . . . . 0.0 109.998 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.93 -57.51 7.69 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.271 -0.893 . . . . 0.0 110.108 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.403 ' NH1' ' CE1' ' A' ' 73' ' ' HIS . 13.7 mmt180 -66.42 -9.89 38.43 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.191 -0.943 . . . . 0.0 109.906 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.984 HD22 HD11 ' A' ' 106' ' ' LEU . 6.2 mt -84.83 -17.65 37.4 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.343 -0.848 . . . . 0.0 110.325 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.472 ' O ' ' O ' ' A' ' 66' ' ' ASP . 25.0 m-20 -110.55 43.05 1.46 Allowed 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.238 -0.914 . . . . 0.0 109.904 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.527 ' OD1' ' CE2' ' A' ' 109' ' ' PHE . 5.5 p-10 -52.73 -167.88 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.453 -0.779 . . . . 0.0 110.408 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.75 -175.49 4.46 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.294 -0.878 . . . . 0.0 110.257 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 49.46 -112.6 1.41 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.456 ' CG ' ' O ' ' A' ' 69' ' ' LYS . 1.0 OUTLIER -130.62 57.87 1.71 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.284 -1.127 . . . . 0.0 110.134 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -131.12 32.32 4.3 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.207 -0.933 . . . . 0.0 110.49 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.423 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . 70.0 p-90 -57.13 -18.14 13.76 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.14 -0.975 . . . . 0.0 110.142 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 13.2 mtp180 -52.63 -41.89 64.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.22 -0.925 . . . . 0.0 110.234 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.403 ' CE1' ' NH1' ' A' ' 63' ' ' ARG . 10.0 m170 -60.62 -41.59 95.17 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.192 -0.943 . . . . 0.0 110.085 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.629 HG11 ' CG1' ' A' ' 123' ' ' VAL . 24.7 t -56.05 -50.8 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.289 -0.882 . . . . 0.0 110.022 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.558 ' CE1' ' O ' ' A' ' 122' ' ' ASN . 7.4 t80 -49.47 -56.7 8.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.207 -0.933 . . . . 0.0 110.226 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -59.19 -26.93 65.24 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.196 -0.94 . . . . 0.0 109.951 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.776 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -70.15 -28.68 65.54 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 110.182 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.694 ' SD ' HD21 ' A' ' 64' ' ' LEU . 1.6 mpp? -76.43 -32.08 58.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.405 -0.809 . . . . 0.0 110.229 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 9.9 m -66.9 -40.18 87.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.082 -1.011 . . . . 0.0 110.122 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 1.036 HD21 HG22 ' A' ' 24' ' ' VAL . 16.2 tp -64.94 -54.14 35.42 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.333 -0.854 . . . . 0.0 109.783 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.529 ' HE2' HG22 ' A' ' 103' ' ' VAL . 0.2 OUTLIER -59.19 -25.27 63.81 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.868 . . . . 0.0 109.887 179.561 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.579 ' HB2' HD12 ' A' ' 130' ' ' LEU . 0.9 OUTLIER -78.46 -34.13 47.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.252 -0.905 . . . . 0.0 110.385 179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.578 ' O ' HG22 ' A' ' 87' ' ' THR . 26.0 t80 -85.6 -16.61 38.72 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.262 -0.899 . . . . 0.0 110.714 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.725 HD23 ' HB2' ' A' ' 44' ' ' ALA . 85.1 mt -92.54 -38.98 11.62 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.166 -0.959 . . . . 0.0 110.232 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.856 HD13 HD11 ' A' ' 134' ' ' LEU . 52.0 mt -57.1 -17.19 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.115 -0.991 . . . . 0.0 109.807 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.58 -80.54 0.47 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.294 -0.879 . . . . 0.0 110.191 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.578 HG22 ' O ' ' A' ' 83' ' ' TYR . 15.0 t -77.72 -18.77 56.22 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.201 -0.937 . . . . 0.0 110.142 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.479 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -55.99 -74.35 0.33 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.212 -1.555 . . . . 0.0 109.212 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 174.47 152.43 0.11 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -1.12 . . . . 0.0 110.337 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -51.98 -24.43 6.53 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 110.109 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.517 ' O ' ' HG2' ' A' ' 94' ' ' GLN . 40.4 mtt180 -70.26 -44.23 68.88 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.304 -0.873 . . . . 0.0 109.722 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 47' ' ' THR . 39.7 t -59.04 -22.16 21.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 120.874 -1.141 . . . . 0.0 108.995 179.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.703 ' HB2' HG23 ' A' ' 85' ' ' ILE . 1.9 t -95.18 -19.2 20.26 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.585 -0.697 . . . . 0.0 110.49 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.598 ' CG ' ' N ' ' A' ' 95' ' ' GLN . 7.2 pt20 -79.53 -48.2 14.26 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.93 -1.106 . . . . 0.0 109.104 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.598 ' N ' ' CG ' ' A' ' 94' ' ' GLN . 7.9 tt0 -63.12 -36.45 83.65 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 36.4 t -59.77 -36.27 76.32 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.344 -0.848 . . . . 0.0 109.403 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.18 -35.53 66.41 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.417 -0.802 . . . . 0.0 109.466 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -74.46 -18.29 60.65 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.481 -0.762 . . . . 0.0 109.652 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -121.97 36.8 4.53 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.511 -0.743 . . . . 0.0 109.988 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.845 ' SD ' HG13 ' A' ' 131' ' ' VAL . 2.0 tpp -59.57 -30.19 68.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.196 -0.94 . . . . 0.0 110.032 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.462 ' O ' ' HB ' ' A' ' 105' ' ' THR . 17.5 m-85 -62.03 -30.04 70.69 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.287 -0.883 . . . . 0.0 109.878 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.957 ' O ' HG22 ' A' ' 105' ' ' THR . . . -70.34 -40.18 74.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.341 -0.849 . . . . 0.0 110.13 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.529 HG22 ' HE2' ' A' ' 81' ' ' MET . 4.6 t -74.86 -27.84 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.354 -0.841 . . . . 0.0 110.332 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.513 ' O ' ' CG ' ' A' ' 107' ' ' LYS . 2.0 mm100 -88.63 -19.51 26.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.314 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.957 HG22 ' O ' ' A' ' 102' ' ' ALA . 11.0 t -67.14 -14.73 63.18 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.17 -0.956 . . . . 0.0 109.985 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.984 HD11 HD22 ' A' ' 64' ' ' LEU . 56.6 mt -77.01 -37.82 54.29 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.348 -0.845 . . . . 0.0 110.169 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.542 ' HA ' ' CB ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -53.93 -20.17 5.71 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.276 -0.89 . . . . 0.0 110.085 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.3 -30.0 17.76 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.308 -0.87 . . . . 0.0 110.322 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.527 ' CE2' ' OD1' ' A' ' 66' ' ' ASP . 0.1 OUTLIER -44.92 108.32 0.12 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.232 -0.917 . . . . 0.0 110.236 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 110' ' ' GLN . 15.0 pt20 -145.1 112.87 6.33 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.274 -0.892 . . . . 0.0 110.247 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -127.3 100.95 6.27 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.206 -0.934 . . . . 0.0 110.278 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.496 ' O ' HG13 ' A' ' 112' ' ' VAL . 3.1 p -138.0 27.49 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.208 -0.933 . . . . 0.0 110.365 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.32 -79.33 0.09 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.239 -0.913 . . . . 0.0 110.202 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -47.16 60.38 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.276 -0.89 . . . . 0.0 110.379 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.32 -89.33 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.234 -0.916 . . . . 0.0 110.14 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.46 ' CA ' HG22 ' A' ' 112' ' ' VAL . . . 120.7 11.02 6.71 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.3 mmmt -122.85 97.53 5.49 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.223 -1.163 . . . . 0.0 110.261 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.82 114.14 1.0 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.301 -0.875 . . . . 0.0 110.114 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -147.06 26.08 1.1 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.164 -0.96 . . . . 0.0 110.2 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -116.22 43.6 1.63 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.609 HG22 ' HG3' ' A' ' 125' ' ' GLU . 3.4 p -93.12 -42.8 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.253 -1.145 . . . . 0.0 110.213 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.558 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 20.7 m-20 -37.16 -28.77 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.8 -0.562 . . . . 0.0 110.788 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.629 ' CG1' HG11 ' A' ' 74' ' ' VAL . 20.4 t -86.25 -63.06 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.247 -0.908 . . . . 0.0 110.303 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.542 ' CB ' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -41.96 -34.01 0.63 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.154 -0.966 . . . . 0.0 110.935 -179.578 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.609 ' HG3' HG22 ' A' ' 121' ' ' VAL . 3.2 mt-10 -82.18 -54.57 5.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.084 -1.01 . . . . 0.0 111.311 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.535 ' HB3' ' HE2' ' A' ' 78' ' ' MET . 0.0 OUTLIER -50.72 -50.14 56.07 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.969 -1.082 . . . . 0.0 110.338 -179.395 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.463 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -61.22 -42.87 99.36 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.38 -0.825 . . . . 0.0 110.408 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -55.51 -56.52 19.28 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.248 -0.907 . . . . 0.0 110.416 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -44.2 65.4 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.265 -0.897 . . . . 0.0 110.494 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.579 HD12 ' HB2' ' A' ' 82' ' ' GLU . 1.1 tt -56.04 -40.89 74.15 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.115 -0.991 . . . . 0.0 110.134 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.845 HG13 ' SD ' ' A' ' 100' ' ' MET . 38.6 t -68.13 -24.8 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.369 -0.832 . . . . 0.0 110.031 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -75.81 -51.66 12.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.351 -0.843 . . . . 0.0 110.385 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -35.13 21.52 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 0.0 110.667 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.856 HD11 HD13 ' A' ' 85' ' ' ILE . 0.9 OUTLIER -84.85 -40.83 16.65 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.425 -179.75 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -105.16 95.8 6.09 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.247 -0.908 . . . . 0.0 110.279 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -153.91 -77.61 0.11 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.301 -0.874 . . . . 0.0 110.337 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 138' ' ' ASP . 0.0 OUTLIER -172.25 -152.13 0.07 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.294 -0.879 . . . . 0.0 110.225 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.468 ' HB2' ' O ' ' A' ' 137' ' ' GLU . 22.0 m-20 57.17 157.19 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.43 -0.793 . . . . 0.0 110.361 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 140' ' ' LEU . 0.0 OUTLIER 38.52 29.83 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.456 -0.778 . . . . 0.0 110.707 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.465 ' N ' ' O ' ' A' ' 138' ' ' ASP . 0.9 OUTLIER 43.56 -167.81 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.337 -0.852 . . . . 0.0 110.174 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -84.89 -16.28 41.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.2 -0.937 . . . . 0.0 110.265 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -151.96 -52.83 0.12 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.163 -0.961 . . . . 0.0 110.271 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.407 ' HB2' ' HB2' ' A' ' 140' ' ' LEU . 10.0 tt0 49.51 60.8 3.52 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.225 -0.922 . . . . 0.0 110.182 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 144' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.218 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . 0.421 ' O ' ' OG ' ' A' ' -2' ' ' SER . 0.3 OUTLIER 61.05 29.04 18.72 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.221 -1.164 . . . . 0.0 110.224 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.06 79.48 3.58 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.176 -0.952 . . . . 0.0 110.177 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.02 92.58 0.95 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.276 -0.89 . . . . 0.0 110.247 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 ttt -86.17 135.44 33.58 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.218 -0.926 . . . . 0.0 110.251 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.63 159.1 42.95 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.307 -0.871 . . . . 0.0 110.156 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.2 p -104.82 68.66 0.84 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.195 -0.941 . . . . 0.0 110.18 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.402 ' O ' ' C ' ' A' ' 5' ' ' SER . 0.1 OUTLIER -174.23 29.78 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.372 -0.83 . . . . 0.0 110.17 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 6' ' ' LEU . 9.9 m -44.56 157.24 0.07 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.167 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.42 ' HA ' HD12 ' A' ' 6' ' ' LEU . 5.7 tp 62.91 112.91 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.278 -0.889 . . . . 0.0 110.205 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.24 -154.21 0.54 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.185 -0.947 . . . . 0.0 110.17 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.8 ptt-85 -87.78 -167.08 1.76 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.221 -0.925 . . . . 0.0 110.215 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.65 134.6 50.15 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.301 -0.874 . . . . 0.0 110.17 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 21.6 mtp -105.88 -179.76 4.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.249 -0.907 . . . . 0.0 110.184 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 mmtt -62.78 -14.76 48.91 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.903 . . . . 0.0 110.051 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.14 132.2 51.66 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.26 -0.9 . . . . 0.0 110.188 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.9 mt -71.37 130.14 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.283 -0.885 . . . . 0.0 110.162 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.453 HG12 ' H ' ' A' ' 15' ' ' HIS . 4.8 t -95.66 173.62 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.277 -0.89 . . . . 0.0 110.228 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.453 ' H ' HG12 ' A' ' 14' ' ' VAL . 13.2 m170 -68.69 109.31 3.75 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.225 -0.922 . . . . 0.0 110.407 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -107.93 115.52 30.28 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.328 -0.857 . . . . 0.0 110.163 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -70.52 149.01 47.59 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.26 -0.9 . . . . 0.0 110.343 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.82 -14.79 43.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.209 -0.932 . . . . 0.0 110.028 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 51.52 22.64 1.59 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.344 -0.848 . . . . 0.0 110.376 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.68 ' HB2' HD13 ' A' ' 46' ' ' LEU . . . -65.93 -46.14 79.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.178 -0.951 . . . . 0.0 110.067 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.488 ' HG3' HG13 ' A' ' 22' ' ' ILE . 12.8 pt-20 -51.97 -28.81 18.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.158 -0.964 . . . . 0.0 110.014 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.488 HG13 ' HG3' ' A' ' 21' ' ' GLU . 64.4 mt -79.34 -47.32 22.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.292 -0.88 . . . . 0.0 109.992 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.573 ' O ' HD11 ' A' ' 43' ' ' ILE . 1.8 ttmt -57.91 -30.13 65.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.313 -0.867 . . . . 0.0 110.112 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.792 HG22 HD21 ' A' ' 80' ' ' LEU . 42.4 t -78.96 -41.71 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 109.949 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.506 ' HG2' ' NH1' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -55.59 -42.75 75.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.293 -0.88 . . . . 0.0 109.971 179.88 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -76.21 -30.48 58.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.332 -0.855 . . . . 0.0 110.048 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.768 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -66.05 -16.03 63.57 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.26 -0.9 . . . . 0.0 110.014 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.555 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 80.7 p -107.89 1.47 22.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.242 -0.911 . . . . 0.0 110.137 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.401 ' HB3' ' NE2' ' A' ' 73' ' ' HIS . 87.9 p -152.92 60.1 0.79 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.276 -0.89 . . . . 0.0 110.272 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -87.13 170.88 11.12 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 110.161 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -77.96 156.49 79.69 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.913 . . . . 0.0 110.119 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.436 ' O ' ' HB2' ' A' ' 33' ' ' TRP . 12.1 Cg_endo -61.88 -160.86 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.034 1.544 . . . . 0.0 110.282 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.436 ' HB2' ' O ' ' A' ' 32' ' ' PRO . 2.4 m95 62.54 -87.96 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.081 -1.012 . . . . 0.0 110.552 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -138.49 100.28 0.29 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -55.27 -165.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 124.034 1.544 . . . . 0.0 110.476 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.75 93.52 8.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.227 -0.921 . . . . 0.0 110.229 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.98 -24.29 66.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.26 -0.9 . . . . 0.0 110.203 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 11.8 t -98.43 42.55 1.09 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.347 -0.846 . . . . 0.0 110.165 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.768 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER -127.09 -31.19 2.62 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.327 -0.858 . . . . 0.0 110.224 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -58.01 4.0 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.223 -0.923 . . . . 0.0 110.15 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -44.64 -35.19 2.49 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.321 -0.862 . . . . 0.0 110.168 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.508 ' HB3' ' HD3' ' A' ' 23' ' ' LYS . 29.5 mt-10 -68.4 -56.75 7.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 110.11 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.682 HG21 HD11 ' A' ' 80' ' ' LEU . 5.8 mt -48.64 -35.01 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.0 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.647 ' HA ' HD22 ' A' ' 84' ' ' LEU . . . -69.75 -51.7 31.79 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.204 -0.935 . . . . 0.0 109.776 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.424 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 7.0 m-20 -51.59 -21.74 2.79 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.045 -1.034 . . . . 0.0 109.114 179.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.68 HD13 ' HB2' ' A' ' 20' ' ' ALA . 21.4 mt -81.35 -38.48 26.58 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.557 -0.715 . . . . 0.0 110.168 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.559 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 77.3 p -51.07 -42.39 60.54 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.201 -0.937 . . . . 0.0 109.453 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.514 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 74.9 m-85 -43.82 -45.74 7.5 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.732 -0.787 . . . . 0.0 109.191 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.456 ' O ' ' O ' ' A' ' 48' ' ' TYR . 2.1 t-20 -56.61 -159.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 121.816 0.817 . . . . 0.0 110.32 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.1 t -124.76 -32.9 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-O 121.52 0.676 . . . . 0.0 109.4 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.561 HG12 ' N ' ' A' ' 52' ' ' ALA . 13.1 t -84.6 -72.72 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.397 0 CA-C-O 122.059 0.933 . . . . 0.0 109.816 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.561 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -39.14 -41.02 0.78 Allowed 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.482 -178.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.559 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 27.3 t80 -55.56 -53.78 52.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.467 -0.771 . . . . 0.0 109.839 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.72 -27.22 67.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.284 -0.885 . . . . 0.0 109.985 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -82.98 -19.39 37.17 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.286 -0.884 . . . . 0.0 110.018 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.682 ' HA ' HG21 ' A' ' 24' ' ' VAL . 11.2 mt -82.09 -68.8 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.694 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.519 ' SD ' HG13 ' A' ' 92' ' ' VAL . 94.3 mmm -47.27 -34.82 7.03 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.297 -0.877 . . . . 0.0 109.484 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.09 -62.53 1.75 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.432 -0.792 . . . . 0.0 109.85 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.48 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.3 OUTLIER -57.4 -20.18 28.2 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.268 -0.895 . . . . 0.0 109.763 179.532 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.653 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.4 OUTLIER -77.99 -32.99 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.815 . . . . 0.0 109.987 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.475 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 20.4 m95 -76.43 -43.66 39.18 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.905 . . . . 0.0 110.267 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.47 -54.51 46.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.338 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.506 ' NH1' ' HG2' ' A' ' 25' ' ' ARG . 8.4 mtt-85 -69.04 -14.15 62.86 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.23 -0.919 . . . . 0.0 110.184 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.885 HD22 HD11 ' A' ' 106' ' ' LEU . 4.2 mt -77.87 -24.82 48.41 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.215 -0.928 . . . . 0.0 110.189 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.491 ' O ' ' O ' ' A' ' 66' ' ' ASP . 1.5 m-20 -114.62 45.07 1.62 Allowed 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.417 -0.802 . . . . 0.0 109.806 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.491 ' O ' ' O ' ' A' ' 65' ' ' ASN . 9.5 p-10 -56.22 -154.97 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.546 -0.721 . . . . 0.0 110.434 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -123.79 179.89 4.64 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.15 -0.969 . . . . 0.0 110.538 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.58 ' HA3' ' CD2' ' A' ' 111' ' ' TYR . . . -49.46 -36.03 22.92 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.666 -1.373 . . . . 0.0 109.666 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.502 ' C ' ' O ' ' A' ' 68' ' ' GLY . 1.6 tptp -28.77 -70.79 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.979 0 O-C-N 122.312 -0.522 . . . . 0.0 111.439 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.451 ' O ' ' OD2' ' A' ' 66' ' ' ASP . 7.3 m-20 -153.1 108.04 3.19 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.285 -0.885 . . . . 0.0 110.639 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.479 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 25.1 p-90 -66.57 -7.07 17.65 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.372 -0.83 . . . . 0.0 110.043 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.3 -47.49 36.47 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.092 -1.005 . . . . 0.0 109.983 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.401 ' NE2' ' HB3' ' A' ' 29' ' ' SER . 0.0 OUTLIER -52.27 -40.15 61.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.235 -0.916 . . . . 0.0 109.984 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.754 HG11 HD22 ' A' ' 106' ' ' LEU . 49.5 t -63.09 -57.6 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.421 -0.799 . . . . 0.0 110.25 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.569 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 11.2 t80 -44.76 -55.7 5.1 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.456 -0.777 . . . . 0.0 110.161 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.555 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 12.3 mmtt -61.71 -31.43 71.58 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.239 -0.913 . . . . 0.0 110.069 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.828 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -66.98 -24.4 66.04 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.243 -0.91 . . . . 0.0 109.754 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.661 ' HG2' HD21 ' A' ' 64' ' ' LEU . 0.3 OUTLIER -79.44 -31.4 42.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.359 -0.838 . . . . 0.0 110.144 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 93.5 m -68.58 -35.33 77.23 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.253 -0.904 . . . . 0.0 110.328 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.792 HD21 HG22 ' A' ' 24' ' ' VAL . 30.9 tp -73.25 -36.66 66.42 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.206 -0.934 . . . . 0.0 109.764 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.647 ' O ' HD12 ' A' ' 85' ' ' ILE . 3.6 ttp -71.0 -34.75 71.67 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.167 -0.958 . . . . 0.0 109.823 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.548 ' HB2' HD13 ' A' ' 130' ' ' LEU . 16.4 tt0 -75.72 -36.14 60.05 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.319 -0.863 . . . . 0.0 110.81 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.564 ' O ' HG22 ' A' ' 87' ' ' THR . 54.0 t80 -72.18 -42.77 65.49 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.168 -0.957 . . . . 0.0 110.455 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.647 HD22 ' HA ' ' A' ' 44' ' ' ALA . 53.8 mt -71.42 -29.1 64.5 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.154 -0.966 . . . . 0.0 110.304 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.714 HG13 HG12 ' A' ' 92' ' ' VAL . 22.6 mt -64.0 -23.17 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.115 -0.991 . . . . 0.0 109.883 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -98.98 -69.58 0.76 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.946 . . . . 0.0 110.167 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.564 HG22 ' O ' ' A' ' 83' ' ' TYR . 14.3 t -84.39 -27.18 27.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.253 -0.904 . . . . 0.0 110.238 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.514 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -48.51 -73.42 0.34 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 7.2 t 174.35 162.91 0.2 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -1.143 . . . . 0.0 110.199 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -62.27 -12.69 22.0 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.274 -0.891 . . . . 0.0 110.199 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.484 ' NH2' ' HG3' ' A' ' 94' ' ' GLN . 5.9 mmp_? -79.01 -43.05 25.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.259 -0.901 . . . . 0.0 110.265 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.714 HG12 HG13 ' A' ' 85' ' ' ILE . 82.4 t -60.13 -26.0 35.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.189 -0.944 . . . . 0.0 109.955 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.82 -31.42 23.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.31 -0.869 . . . . 0.0 109.732 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.484 ' HG3' ' NH2' ' A' ' 91' ' ' ARG . 13.3 mm100 -67.95 -48.69 65.18 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.302 -0.874 . . . . 0.0 109.807 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -59.42 -36.88 76.7 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.34 -0.85 . . . . 0.0 109.585 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.712 ' HB3' HD13 ' A' ' 134' ' ' LEU . 44.5 m -56.96 -42.18 79.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.392 -0.817 . . . . 0.0 109.524 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.0 tttp -68.48 -29.07 67.6 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.461 -0.774 . . . . 0.0 109.679 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -83.64 -14.59 51.55 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.387 -0.821 . . . . 0.0 110.077 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -126.21 39.78 3.87 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.364 -0.835 . . . . 0.0 110.271 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 6.1 ttm -65.5 -30.07 70.8 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.186 -0.947 . . . . 0.0 110.206 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.449 ' O ' ' HB ' ' A' ' 105' ' ' THR . 59.7 m-85 -64.39 -12.59 44.29 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.288 -0.883 . . . . 0.0 110.018 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.835 ' O ' HG22 ' A' ' 105' ' ' THR . . . -90.61 -40.67 11.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 110.224 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.443 HG12 HG23 ' A' ' 131' ' ' VAL . 2.4 t -75.94 -21.01 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.322 -0.862 . . . . 0.0 109.911 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -91.53 -26.43 18.77 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.373 -0.83 . . . . 0.0 110.316 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.835 HG22 ' O ' ' A' ' 102' ' ' ALA . 9.2 t -65.4 -16.04 63.21 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.91 . . . . 0.0 110.177 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.885 HD11 HD22 ' A' ' 64' ' ' LEU . 15.4 mt -70.58 -39.85 73.62 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.283 -0.886 . . . . 0.0 110.336 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 10.4 mtmt -49.64 -33.98 16.98 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.331 -0.855 . . . . 0.0 110.195 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -86.72 -25.99 24.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.379 -0.825 . . . . 0.0 110.283 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -45.39 107.69 0.1 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.153 -0.967 . . . . 0.0 110.265 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -140.56 161.86 36.73 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.297 -0.877 . . . . 0.0 110.183 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.58 ' CD2' ' HA3' ' A' ' 68' ' ' GLY . 0.7 OUTLIER -165.85 127.61 1.93 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.257 -0.902 . . . . 0.0 110.104 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.761 HG22 ' O ' ' A' ' 117' ' ' LYS . 46.0 t -148.47 80.7 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.231 -0.918 . . . . 0.0 110.333 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.03 -63.97 1.35 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.341 -0.85 . . . . 0.0 110.065 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.443 ' CG ' ' N ' ' A' ' 115' ' ' ASP . 1.4 ptm85 -72.57 -47.05 51.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.249 -0.907 . . . . 0.0 110.45 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.443 ' N ' ' CG ' ' A' ' 114' ' ' ARG . 0.4 OUTLIER -75.63 -28.35 58.76 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.331 -0.855 . . . . 0.0 110.416 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.576 ' C ' HG13 ' A' ' 112' ' ' VAL . . . 66.82 13.95 62.26 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.761 ' O ' HG22 ' A' ' 112' ' ' VAL . 1.6 tttt -131.69 146.93 52.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.285 -1.126 . . . . 0.0 110.182 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -99.38 114.4 27.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.283 -0.885 . . . . 0.0 110.176 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -133.18 28.79 4.08 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.228 -0.92 . . . . 0.0 110.285 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -91.0 37.46 3.38 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.0 p -81.38 -43.51 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.302 -1.116 . . . . 0.0 110.107 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.9 OUTLIER -50.88 -49.31 59.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.452 -0.78 . . . . 0.0 110.498 -179.838 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.612 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 9.7 p -77.3 -16.0 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.164 -0.96 . . . . 0.0 110.398 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -66.97 0.78 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.197 -0.939 . . . . 0.0 110.599 -179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.475 ' CG ' ' N ' ' A' ' 126' ' ' LYS . 13.8 pt-20 -60.02 -43.62 95.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.398 -0.814 . . . . 0.0 110.679 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.569 ' HG3' ' CE1' ' A' ' 75' ' ' TYR . 7.4 tmtm? -54.55 -51.64 64.6 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.125 -0.985 . . . . 0.0 110.161 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.564 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -53.99 -41.37 67.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.145 -0.972 . . . . 0.0 110.15 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.423 ' HB3' ' HE2' ' A' ' 128' ' ' LYS . 30.0 ttpt -58.21 -39.93 80.28 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.226 -0.921 . . . . 0.0 110.041 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.459 ' HB2' ' O ' ' A' ' 126' ' ' LYS . 7.9 mt-30 -57.3 -48.61 78.5 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.305 -0.872 . . . . 0.0 110.174 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.58 ' O ' HD12 ' A' ' 134' ' ' LEU . 9.2 tp -57.59 -28.78 63.92 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.172 -0.955 . . . . 0.0 109.677 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.443 HG23 HG12 ' A' ' 103' ' ' VAL . 43.1 t -78.29 -27.9 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.343 -0.848 . . . . 0.0 109.513 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.787 ' HB1' ' OD1' ' A' ' 136' ' ' ASP . . . -72.61 -53.35 12.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.461 -0.774 . . . . 0.0 110.252 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.2 mp -56.13 -32.71 64.48 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.231 -0.918 . . . . 0.0 110.176 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.712 HD13 ' HB3' ' A' ' 96' ' ' CYS . 31.4 mt -79.42 -23.69 43.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 0.0 110.192 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -164.38 64.87 0.15 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.24 -0.913 . . . . 0.0 110.122 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.787 ' OD1' ' HB1' ' A' ' 132' ' ' ALA . 0.3 OUTLIER -81.54 -66.37 0.9 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 110.231 -179.82 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.465 ' HB3' ' O ' ' A' ' 136' ' ' ASP . 14.0 tp10 57.33 89.59 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.174 -0.954 . . . . 0.0 110.216 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -102.13 -167.61 1.43 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.323 -0.861 . . . . 0.0 110.251 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -77.68 137.48 38.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.318 -0.864 . . . . 0.0 110.211 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.8 79.22 1.42 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.216 -0.928 . . . . 0.0 110.171 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.61 -86.12 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.199 -0.938 . . . . 0.0 110.189 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -130.51 -175.28 3.6 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 144' ' ' ARG . 7.1 mt-10 -119.32 83.97 2.12 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.294 -0.879 . . . . 0.0 110.279 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.432 ' CB ' ' O ' ' A' ' 143' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.26 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 8.6 t -104.09 162.61 13.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.277 -1.131 . . . . 0.0 110.164 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.52 130.46 50.91 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 0.0 110.205 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -123.55 49.21 1.74 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.33 -0.856 . . . . 0.0 110.291 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.9 tpt -73.56 115.54 13.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 110.242 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.87 115.54 24.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.163 -0.96 . . . . 0.0 110.262 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 36.1 p -89.93 119.0 29.92 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.27 -0.894 . . . . 0.0 110.166 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.1 m -66.86 -160.97 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.29 -0.881 . . . . 0.0 110.118 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.5 m -129.1 165.77 20.58 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.214 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -104.65 34.08 3.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.306 -0.871 . . . . 0.0 110.144 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -102.38 26.75 7.44 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 110.277 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.8 mtt180 -150.44 145.65 26.17 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.193 -0.942 . . . . 0.0 110.243 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -91.71 166.46 12.77 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.276 -0.89 . . . . 0.0 110.211 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.5 ptt? -90.45 175.07 7.22 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.294 -0.879 . . . . 0.0 110.13 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -88.98 -166.99 1.74 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 110.199 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -132.44 59.49 1.72 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.9 . . . . 0.0 110.129 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 tt -85.02 -175.1 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.308 -0.87 . . . . 0.0 110.215 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.1 t -75.45 145.84 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.147 -0.971 . . . . 0.0 110.278 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.427 ' O ' ' HB2' ' A' ' 16' ' ' ASN . 36.5 m-70 -120.43 163.39 17.98 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.23 -0.919 . . . . 0.0 110.158 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 15' ' ' HIS . 2.8 t30 -177.26 91.74 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.199 -0.938 . . . . 0.0 110.241 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.532 ' O ' ' CB ' ' A' ' 18' ' ' SER . 1.4 p90 -50.05 171.74 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.234 -0.916 . . . . 0.0 110.193 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.532 ' CB ' ' O ' ' A' ' 17' ' ' TYR . 1.3 m 76.08 -73.33 0.09 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.611 -0.68 . . . . 0.0 110.545 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.534 ' HG2' HD12 ' A' ' 22' ' ' ILE . 38.0 mt-10 51.07 32.01 7.17 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.9 -1.125 . . . . 0.0 110.122 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.896 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -66.68 -56.54 10.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.265 -0.897 . . . . 0.0 110.221 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.412 ' C ' ' O ' ' A' ' 20' ' ' ALA . 15.1 pt-20 -42.97 -29.55 0.34 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.306 -0.871 . . . . 0.0 110.197 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.534 HD12 ' HG2' ' A' ' 19' ' ' GLU . 36.4 mt -79.78 -48.73 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.255 -0.903 . . . . 0.0 110.121 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.55 ' O ' HD11 ' A' ' 43' ' ' ILE . 2.6 mmtm -50.46 -35.75 30.34 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 0.0 110.037 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.654 HG13 ' CD2' ' A' ' 80' ' ' LEU . 98.3 t -72.46 -48.15 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.333 -0.855 . . . . 0.0 110.106 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.71 -51.2 40.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.176 -0.952 . . . . 0.0 110.009 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -65.69 -29.17 69.68 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.936 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.789 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -74.28 -19.51 60.47 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.275 -0.891 . . . . 0.0 110.022 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 76' ' ' LYS . 34.5 p -120.42 62.55 0.85 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.328 -0.858 . . . . 0.0 110.262 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.7 t -174.19 -36.26 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.241 -0.912 . . . . 0.0 110.16 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -153.65 152.42 30.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.267 -0.895 . . . . 0.0 110.263 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.534 ' N ' ' CD ' ' A' ' 32' ' ' PRO . 0.5 OUTLIER -158.4 50.1 0.37 Allowed Pre-proline 0 N--CA 1.492 1.651 0 O-C-N 121.286 -0.884 . . . . 0.0 110.243 179.941 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.534 ' CD ' ' N ' ' A' ' 31' ' ' ASP . 17.8 Cg_endo -65.41 -176.32 0.51 Allowed 'Trans proline' 0 C--N 1.305 -1.732 0 O-C-N 124.012 1.532 . . . . 0.0 110.502 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -91.69 -154.05 0.35 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.348 -0.845 . . . . 0.0 110.733 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 146.57 -177.9 24.59 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -62.52 -64.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 123.985 1.518 . . . . 0.0 110.326 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.54 105.33 6.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.243 -0.91 . . . . 0.0 110.131 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.4 t -89.15 148.03 23.88 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.269 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -172.62 101.2 0.14 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.274 -0.891 . . . . 0.0 110.152 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.789 HD21 ' HB2' ' A' ' 27' ' ' ALA . 1.3 tp -139.62 -42.28 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.237 -0.914 . . . . 0.0 110.234 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.5 mtt -60.03 -51.9 67.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.157 -0.964 . . . . 0.0 110.195 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 98.0 p -52.78 -26.32 13.97 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.201 -0.937 . . . . 0.0 110.141 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 39' ' ' LEU . 8.3 mm-40 -78.08 -54.99 5.65 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.251 -0.906 . . . . 0.0 110.2 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.766 HG21 HD11 ' A' ' 80' ' ' LEU . 54.6 mt -51.83 -38.11 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.187 -0.945 . . . . 0.0 109.998 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.492 ' CA ' HD22 ' A' ' 84' ' ' LEU . . . -68.61 -53.16 24.35 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.09 -1.006 . . . . 0.0 109.269 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.5 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 4.9 t70 -51.25 -22.06 2.49 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.13 -0.981 . . . . 0.0 109.147 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.896 HD22 ' HB2' ' A' ' 20' ' ' ALA . 8.5 mt -80.15 -39.72 28.81 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.5 -0.75 . . . . 0.0 110.053 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.782 HG21 ' HB3' ' A' ' 84' ' ' LEU . 81.7 p -48.54 -38.98 21.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.094 -1.004 . . . . 0.0 109.26 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.585 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 63.3 m-85 -45.28 -49.62 12.45 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.401 -0.92 . . . . 0.0 109.442 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.544 ' O ' ' C ' ' A' ' 50' ' ' VAL . 49.2 m-20 -70.49 92.29 0.82 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.672 -0.642 . . . . 0.0 110.8 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.544 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -12.16 -57.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.21 178.095 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.551 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.6 t -62.54 -64.85 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.07 -1.019 . . . . 0.0 109.888 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.632 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -38.03 -40.98 0.53 Allowed 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.302 0.572 . . . . 0.0 110.568 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.61 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 29.1 t80 -64.81 -57.48 8.77 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.453 -0.779 . . . . 0.0 110.265 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -26.82 9.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.213 -0.929 . . . . 0.0 110.016 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -84.17 -31.72 24.99 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.238 -0.914 . . . . 0.0 109.981 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.824 HD11 ' HB3' ' A' ' 46' ' ' LEU . 17.0 mt -74.66 -68.48 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.396 -0.815 . . . . 0.0 110.117 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.61 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 14.1 mmm -43.8 -38.83 3.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.267 -0.896 . . . . 0.0 109.729 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.83 -59.87 3.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.394 -0.816 . . . . 0.0 109.951 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 16.4 mmt -60.11 -21.94 62.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.263 -0.898 . . . . 0.0 109.896 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.666 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -76.92 -28.28 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.425 -0.797 . . . . 0.0 109.878 179.898 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 14.4 m95 -81.99 -29.54 32.03 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.276 -0.89 . . . . 0.0 110.373 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -58.54 3.4 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.378 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -64.57 -24.02 67.46 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.185 -0.947 . . . . 0.0 110.139 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.99 HD22 HD11 ' A' ' 106' ' ' LEU . 5.6 mt -66.14 -16.28 63.83 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.0 110.392 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.473 ' O ' ' O ' ' A' ' 66' ' ' ASP . 22.9 m-20 -113.59 43.48 1.77 Allowed 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.293 -0.879 . . . . 0.0 110.058 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.578 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -53.82 -166.78 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.374 -0.829 . . . . 0.0 110.297 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.426 ' O ' ' C ' ' A' ' 68' ' ' GLY . 0.2 OUTLIER -151.32 -169.45 3.38 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 110.474 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.426 ' C ' ' O ' ' A' ' 67' ' ' HIS . . . 42.49 -128.75 4.86 Favored Glycine 0 N--CA 1.489 2.176 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.55 16.7 19.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.397 -1.061 . . . . 0.0 110.207 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -86.44 35.74 0.67 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.323 -0.86 . . . . 0.0 110.376 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.435 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 19.6 p-90 -63.3 -10.31 15.63 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.251 -0.906 . . . . 0.0 110.381 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 39.2 mtt85 -48.93 -46.21 42.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.107 -0.996 . . . . 0.0 110.092 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 -58.73 -48.88 79.65 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.227 -0.92 . . . . 0.0 110.107 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.744 HG12 HG13 ' A' ' 123' ' ' VAL . 16.9 t -46.62 -44.72 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.269 -0.895 . . . . 0.0 110.181 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.51 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 4.0 t80 -55.72 -54.87 39.02 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.251 -0.906 . . . . 0.0 110.283 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.556 ' O ' HG22 ' A' ' 28' ' ' THR . 0.2 OUTLIER -71.17 -9.11 57.52 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.898 -1.126 . . . . 0.0 109.52 179.525 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.934 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -79.16 -70.2 0.52 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.395 -0.815 . . . . 0.0 110.941 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.574 ' HE1' HG13 ' A' ' 123' ' ' VAL . 0.7 OUTLIER -56.63 -26.7 56.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.114 -0.991 . . . . 0.0 110.105 -179.487 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.426 ' O ' ' C ' ' A' ' 80' ' ' LEU . 61.2 m -63.65 -65.2 0.71 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.031 -1.043 . . . . 0.0 109.439 179.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.766 HD11 HG21 ' A' ' 43' ' ' ILE . 10.6 tp -42.67 -59.0 2.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.502 -0.748 . . . . 0.0 109.316 178.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.483 ' HE2' ' SG ' ' A' ' 96' ' ' CYS . 19.4 ttt -42.9 -46.08 5.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.359 -0.838 . . . . 0.0 109.836 179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.653 ' HB2' HD12 ' A' ' 130' ' ' LEU . 40.8 tt0 -58.81 -48.57 80.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.356 -0.84 . . . . 0.0 109.779 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.424 ' CE1' HG21 ' A' ' 87' ' ' THR . 22.9 t80 -54.48 -37.39 65.2 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.41 -0.806 . . . . 0.0 110.183 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.92 ' HB2' HG11 ' A' ' 92' ' ' VAL . 2.6 mt -74.67 -28.45 60.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.273 -0.892 . . . . 0.0 110.007 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.994 HD13 HD11 ' A' ' 134' ' ' LEU . 32.2 mt -70.22 -26.05 28.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.037 -1.039 . . . . 0.0 109.962 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -88.77 -68.68 0.75 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.261 -0.9 . . . . 0.0 110.383 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.438 ' O ' ' OH ' ' A' ' 48' ' ' TYR . 14.5 t -95.1 -22.73 17.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.201 -0.937 . . . . 0.0 110.49 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.585 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -47.68 -77.17 0.12 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 88' ' ' GLY . 6.2 p -178.71 171.45 1.48 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.169 -1.195 . . . . 0.0 110.301 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -71.47 -13.8 61.93 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.272 -0.892 . . . . 0.0 110.219 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 15.7 mmt180 -79.48 -41.51 27.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.25 -0.906 . . . . 0.0 109.989 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.92 HG11 ' HB2' ' A' ' 84' ' ' LEU . 93.3 t -56.26 -33.24 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.263 -0.898 . . . . 0.0 109.865 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.47 ' O ' ' HB3' ' A' ' 96' ' ' CYS . 1.6 t -76.15 -40.97 51.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.289 -0.882 . . . . 0.0 109.849 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -57.18 -56.58 19.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.309 -0.869 . . . . 0.0 109.861 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -52.92 -38.75 62.22 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.361 -0.837 . . . . 0.0 109.568 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.483 ' SG ' ' HE2' ' A' ' 81' ' ' MET . 48.9 t -54.67 -43.84 72.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.359 -0.838 . . . . 0.0 109.693 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 17.2 mttt -65.44 -35.81 82.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.352 -0.842 . . . . 0.0 109.675 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -78.24 -12.68 60.01 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.421 -0.799 . . . . 0.0 109.842 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -134.04 30.41 3.65 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.458 -0.776 . . . . 0.0 110.119 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 4.9 ptt? -62.99 -24.92 68.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.178 -0.951 . . . . 0.0 110.009 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.469 ' O ' ' HB ' ' A' ' 105' ' ' THR . 2.7 m-85 -65.76 -23.84 66.82 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.213 -0.929 . . . . 0.0 109.99 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.991 ' O ' HG22 ' A' ' 105' ' ' THR . . . -78.37 -40.89 34.91 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.381 -0.825 . . . . 0.0 110.193 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.701 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 5.3 t -72.17 -27.64 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.306 -0.871 . . . . 0.0 110.151 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.78 ' HG2' HG21 ' A' ' 131' ' ' VAL . 3.4 mm100 -86.84 -29.36 22.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.327 -0.858 . . . . 0.0 110.372 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.991 HG22 ' O ' ' A' ' 102' ' ' ALA . 11.0 t -57.59 -19.38 25.45 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.236 -0.915 . . . . 0.0 110.232 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.99 HD11 HD22 ' A' ' 64' ' ' LEU . 20.4 mt -68.97 -40.65 78.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.251 -0.906 . . . . 0.0 110.255 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 14.9 ttpp -52.64 -20.67 3.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.235 -0.916 . . . . 0.0 110.196 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -103.1 -26.47 13.03 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.27 -0.894 . . . . 0.0 110.364 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -65.41 115.93 6.18 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.232 -0.917 . . . . 0.0 110.342 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -158.43 137.31 11.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 110.144 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.416 ' C ' HG23 ' A' ' 112' ' ' VAL . 2.7 t80 -115.54 137.08 52.43 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.348 -0.845 . . . . 0.0 110.128 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.71 ' O ' HG12 ' A' ' 112' ' ' VAL . 69.3 t -147.76 18.44 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.243 -0.911 . . . . 0.0 110.227 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.43 -169.29 0.11 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.254 -0.903 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.22 -47.53 62.3 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.257 -0.902 . . . . 0.0 110.234 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -149.58 132.74 16.34 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.301 -0.874 . . . . 0.0 110.179 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.42 ' C ' ' CG1' ' A' ' 112' ' ' VAL . . . 175.19 -146.43 8.36 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.407 ' N ' HG13 ' A' ' 112' ' ' VAL . 1.3 ptmm? -139.44 158.37 44.25 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.236 -1.155 . . . . 0.0 110.287 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -45.68 144.41 1.67 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.212 -0.93 . . . . 0.0 110.305 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -92.59 -48.8 6.43 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.278 -0.889 . . . . 0.0 110.208 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -135.79 99.88 0.33 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.564 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.2 p -79.88 -42.14 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.317 -1.108 . . . . 0.0 110.071 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.564 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.6 m-80 -36.6 -30.11 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.218 0.533 . . . . 0.0 110.64 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.744 HG13 HG12 ' A' ' 74' ' ' VAL . 12.6 t -72.7 -62.12 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.339 -0.851 . . . . 0.0 110.283 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -44.47 -43.82 8.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.251 -0.905 . . . . 0.0 110.658 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.539 ' HG3' ' N ' ' A' ' 126' ' ' LYS . 10.0 pt-20 -75.39 -32.22 60.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.276 -0.89 . . . . 0.0 110.717 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.539 ' N ' ' HG3' ' A' ' 125' ' ' GLU . 33.4 tptt -62.07 -52.89 62.08 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.97 -1.081 . . . . 0.0 110.247 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.701 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -58.26 -41.42 84.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.302 -0.874 . . . . 0.0 110.267 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 11.6 tttm -59.67 -38.29 81.09 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.23 -0.919 . . . . 0.0 110.305 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -62.32 -40.62 96.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.281 -0.887 . . . . 0.0 110.6 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.653 HD12 ' HB2' ' A' ' 82' ' ' GLU . 7.9 tt -61.17 -40.39 93.71 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.08 -1.012 . . . . 0.0 110.508 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.78 HG21 ' HG2' ' A' ' 104' ' ' GLN . 54.0 t -77.45 -24.96 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.321 -0.862 . . . . 0.0 110.475 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.0 -52.61 18.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.234 -0.916 . . . . 0.0 110.573 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.742 HD12 ' C ' ' A' ' 133' ' ' LEU . 3.5 pp -66.31 -22.16 66.28 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.181 -0.95 . . . . 0.0 110.371 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.994 HD11 HD13 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -83.02 -69.22 0.64 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.268 -0.895 . . . . 0.0 110.466 -179.777 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.441 ' CD ' ' O ' ' A' ' 135' ' ' ARG . 0.1 OUTLIER -88.51 49.56 1.81 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.185 -0.947 . . . . 0.0 110.226 -179.913 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -82.11 -16.92 48.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.244 -0.91 . . . . 0.0 110.323 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.78 119.92 5.15 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.194 -0.941 . . . . 0.0 110.216 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -169.55 40.69 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.231 -0.918 . . . . 0.0 110.384 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 6.9 ttm105 -102.54 80.53 1.94 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.178 -0.951 . . . . 0.0 110.333 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -132.42 13.01 4.57 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.28 -0.887 . . . . 0.0 110.2 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.86 109.58 3.46 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.248 -0.908 . . . . 0.0 110.154 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -109.77 27.49 9.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.272 -0.892 . . . . 0.0 110.269 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -138.65 -171.43 3.06 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.244 -0.91 . . . . 0.0 110.193 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.169 -0.957 . . . . 0.0 110.224 -179.999 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . 0.409 ' O ' ' CB ' ' A' ' -1' ' ' SER . 0.5 OUTLIER -147.08 60.75 1.18 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.319 -1.106 . . . . 0.0 110.092 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . 0.409 ' CB ' ' O ' ' A' ' -2' ' ' SER . 1.2 m 63.45 153.52 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.251 -0.906 . . . . 0.0 110.087 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 15.8 mmt-85 -142.77 -42.11 0.32 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 110.307 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.8 ttm -58.1 136.29 57.17 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.161 -0.962 . . . . 0.0 110.209 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.3 m -153.19 -87.48 0.06 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.347 -0.846 . . . . 0.0 110.17 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 p -113.34 146.84 38.78 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.921 . . . . 0.0 110.176 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.17 42.26 1.1 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.044 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.437 ' O ' ' O ' ' A' ' 6' ' ' LEU . 13.4 m -122.12 -163.15 1.05 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.337 -0.852 . . . . 0.0 110.216 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.581 HD23 ' O ' ' A' ' 7' ' ' ARG . 7.5 tt 51.03 100.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.211 -0.931 . . . . 0.0 110.299 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.581 ' O ' HD23 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -61.32 175.92 0.52 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.286 -0.884 . . . . 0.0 110.223 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.21 -36.36 1.31 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.194 -0.941 . . . . 0.0 110.272 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.0 107.17 0.59 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.154 -0.966 . . . . 0.0 110.27 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -89.61 -153.86 0.29 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.243 -0.91 . . . . 0.0 110.275 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.1 mtpt -69.17 -52.94 22.97 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.277 -0.89 . . . . 0.0 110.145 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.617 ' C ' HD12 ' A' ' 13' ' ' ILE . 0.7 OUTLIER -149.38 -161.91 1.44 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -0.91 . . . . 0.0 110.139 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.701 HD12 ' N ' ' A' ' 13' ' ' ILE . 5.2 mp -135.06 173.36 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.167 -0.958 . . . . 0.0 110.205 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.564 ' N ' HG22 ' A' ' 13' ' ' ILE . 3.2 m -116.25 165.87 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.22 -0.925 . . . . 0.0 110.227 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -136.11 -178.97 5.39 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -0.907 . . . . 0.0 110.302 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -137.64 80.72 1.82 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.289 -0.882 . . . . 0.0 110.048 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.558 ' CD2' ' HB2' ' A' ' 18' ' ' SER . 32.4 p90 -58.3 -163.28 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 0.0 110.184 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.558 ' HB2' ' CD2' ' A' ' 17' ' ' TYR . 1.1 t 64.29 54.04 1.64 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.191 -0.943 . . . . 0.0 110.165 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -126.56 5.96 6.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.313 -0.867 . . . . 0.0 110.149 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.913 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -60.42 -45.58 93.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.266 -0.896 . . . . 0.0 110.286 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.501 ' HG3' HG13 ' A' ' 22' ' ' ILE . 9.4 pt-20 -43.39 -40.94 3.93 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 110.051 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.501 HG13 ' HG3' ' A' ' 21' ' ' GLU . 37.3 mt -69.45 -40.46 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.2 -0.938 . . . . 0.0 109.968 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 1.0 OUTLIER -59.53 -61.72 2.41 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.287 -0.883 . . . . 0.0 110.122 179.814 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.829 HG13 HD23 ' A' ' 80' ' ' LEU . 84.2 t -48.35 -33.33 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.241 -0.912 . . . . 0.0 110.052 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.415 ' HB3' ' O ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER -64.6 -46.39 82.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.374 -0.829 . . . . 0.0 110.244 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.01 -17.13 61.03 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.384 -0.822 . . . . 0.0 110.19 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.942 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -79.7 -28.1 40.67 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 110.152 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 77.4 p -118.36 45.26 2.05 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.24 -0.912 . . . . 0.0 110.142 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.4 t -168.69 36.48 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.255 -0.903 . . . . 0.0 110.145 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -164.09 146.06 8.98 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.234 -0.916 . . . . 0.0 110.068 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.11 148.26 77.99 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.218 -0.926 . . . . 0.0 110.267 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.404 ' O ' ' HB2' ' A' ' 33' ' ' TRP . 19.1 Cg_endo -64.82 -161.63 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 124.014 1.534 . . . . 0.0 110.287 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.404 ' HB2' ' O ' ' A' ' 32' ' ' PRO . 1.3 m95 63.03 171.24 0.15 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.222 -0.924 . . . . 0.0 110.44 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.422 ' O ' ' O ' ' A' ' 35' ' ' PRO . . . 85.17 -176.39 50.31 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.529 -1.429 . . . . 0.0 109.529 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.449 ' O ' ' CB ' ' A' ' 36' ' ' SER . 23.7 Cg_exo -59.06 -143.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.664 0 O-C-N 124.016 1.535 . . . . 0.0 110.397 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.449 ' CB ' ' O ' ' A' ' 35' ' ' PRO . 0.1 OUTLIER 66.27 108.19 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.355 -0.841 . . . . 0.0 110.162 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.9 t -63.72 -78.45 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.218 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.5 m -149.89 108.57 3.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.148 -0.97 . . . . 0.0 110.243 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.942 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER -83.96 -25.18 30.26 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.935 . . . . 0.0 110.18 179.901 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 19.0 mtp -66.99 -52.36 43.57 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.275 -0.891 . . . . 0.0 110.149 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 t -55.04 -32.08 61.6 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.269 -0.894 . . . . 0.0 110.221 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.94 -46.4 52.7 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.257 -0.902 . . . . 0.0 110.218 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.468 ' O ' ' HB2' ' A' ' 46' ' ' LEU . 68.6 mt -59.81 -31.01 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.129 -0.982 . . . . 0.0 109.853 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.577 ' HA ' HD22 ' A' ' 84' ' ' LEU . . . -70.65 -51.43 27.94 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.135 -0.978 . . . . 0.0 109.434 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.435 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 38.4 t0 -52.68 -21.08 3.6 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.076 -1.015 . . . . 0.0 108.886 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.913 HD13 ' CB ' ' A' ' 20' ' ' ALA . 15.5 mt -79.81 -38.31 33.23 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.488 -0.757 . . . . 0.0 110.247 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.535 ' HA ' ' CA ' ' A' ' 53' ' ' PHE . 55.3 p -52.49 -45.41 66.15 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.946 -1.096 . . . . 0.0 109.063 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.435 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 90.4 m-85 -43.58 -41.98 4.84 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.763 -0.775 . . . . 0.0 109.38 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.535 ' O ' ' N ' ' A' ' 51' ' ' VAL . 0.3 OUTLIER -73.51 91.43 1.81 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.577 -0.702 . . . . 0.0 110.183 179.531 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.532 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.09 -59.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.571 178.309 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.544 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.9 t -65.05 -65.78 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.104 -0.998 . . . . 0.0 110.203 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.811 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -35.64 -46.56 0.43 Allowed 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.099 -177.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.535 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 4.7 t80 -55.4 -56.75 16.58 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.279 -0.888 . . . . 0.0 110.289 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.488 ' O ' ' HB2' ' A' ' 58' ' ' SER . 88.9 p -52.1 -38.88 58.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.206 -0.934 . . . . 0.0 110.245 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -70.14 -29.73 66.73 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.431 -0.793 . . . . 0.0 110.39 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.79 ' HA ' HG21 ' A' ' 24' ' ' VAL . 11.2 mt -77.55 -70.28 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.187 -0.946 . . . . 0.0 110.281 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.54 ' HG3' ' NE1' ' A' ' 61' ' ' TRP . 1.9 tpt -47.19 -34.6 6.48 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.144 -0.972 . . . . 0.0 110.031 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 54' ' ' SER . 32.5 t -57.23 -61.82 2.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.333 -0.854 . . . . 0.0 110.108 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.4 mmt -58.21 -26.62 63.06 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.199 -0.938 . . . . 0.0 109.941 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.773 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -71.6 -31.07 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.299 -0.876 . . . . 0.0 109.88 179.747 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.54 ' NE1' ' HG3' ' A' ' 57' ' ' MET . 11.0 m95 -77.47 -42.93 34.07 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.277 -0.889 . . . . 0.0 110.386 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -60.5 3.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.283 -0.886 . . . . 0.0 110.605 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -13.04 57.96 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.187 -0.946 . . . . 0.0 110.578 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 1.022 HD22 HD11 ' A' ' 106' ' ' LEU . 2.4 mt -74.99 -13.43 60.51 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.162 -0.961 . . . . 0.0 110.576 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -108.3 38.99 2.07 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.15 -0.969 . . . . 0.0 110.379 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.744 ' OD2' HG23 ' A' ' 74' ' ' VAL . 75.8 m-20 -50.95 136.51 22.75 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.179 -0.951 . . . . 0.0 110.048 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.464 ' O ' ' O ' ' A' ' 66' ' ' ASP . 4.9 m-70 -53.08 -169.39 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.587 -0.696 . . . . 0.0 110.177 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.538 ' HA3' ' CD2' ' A' ' 111' ' ' TYR . . . -86.08 58.96 4.74 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 68' ' ' GLY . 28.8 mttp -150.96 -81.9 0.1 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.378 -1.072 . . . . 0.0 110.148 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -84.77 73.93 10.54 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.285 -0.884 . . . . 0.0 110.511 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.47 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 33.7 p-90 -71.44 -13.64 61.9 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.24 -0.912 . . . . 0.0 110.096 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.411 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 14.9 mtt180 -50.69 -42.98 57.46 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.242 -0.911 . . . . 0.0 109.945 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.524 ' CB ' ' OD2' ' A' ' 66' ' ' ASP . 1.3 m170 -54.56 -39.62 67.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.321 -0.862 . . . . 0.0 109.835 179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.756 HG11 ' CG1' ' A' ' 123' ' ' VAL . 42.7 t -60.64 -51.27 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.314 -0.866 . . . . 0.0 109.759 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 74' ' ' VAL . 2.2 t80 -41.79 -61.55 1.08 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.393 -0.817 . . . . 0.0 110.261 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.03 -28.98 70.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.271 -0.893 . . . . 0.0 110.195 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.949 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -61.24 -70.32 0.19 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.185 -0.947 . . . . 0.0 110.166 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.656 ' HE2' HG12 ' A' ' 74' ' ' VAL . 3.0 ptp -50.49 -26.61 5.33 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.398 -0.814 . . . . 0.0 110.023 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 61.2 m -66.68 -47.27 72.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.272 -0.892 . . . . 0.0 109.937 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.829 HD23 HG13 ' A' ' 24' ' ' VAL . 16.6 tp -64.22 -29.7 70.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.428 -0.795 . . . . 0.0 109.838 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.788 ' HG2' HD21 ' A' ' 130' ' ' LEU . 5.2 ttp -71.86 -35.17 69.74 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.333 -0.854 . . . . 0.0 109.893 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.44 ' CB ' HD13 ' A' ' 130' ' ' LEU . 46.2 tt0 -70.87 -56.41 6.34 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.298 -0.876 . . . . 0.0 110.22 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -52.56 -45.06 66.25 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.289 -0.882 . . . . 0.0 110.74 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.608 ' CB ' HG11 ' A' ' 92' ' ' VAL . 59.8 mt -73.0 -29.68 63.21 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.935 . . . . 0.0 110.791 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.635 HG13 HG12 ' A' ' 92' ' ' VAL . 8.5 mt -61.19 -14.28 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 120.859 -1.151 . . . . 0.0 109.635 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 43.0 mttt -107.03 -77.76 0.59 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.241 -0.912 . . . . 0.0 109.97 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.459 HG23 ' HB1' ' A' ' 44' ' ' ALA . 13.5 t -82.49 2.88 30.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.881 . . . . 0.0 110.019 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.586 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -93.39 30.06 7.66 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.2 OUTLIER 75.74 148.59 0.1 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.58 -0.953 . . . . 0.0 110.41 -179.933 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.3 -9.72 13.01 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.48 -0.763 . . . . 0.0 110.542 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 17.4 mtt-85 -71.46 -43.13 67.19 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.184 -0.948 . . . . 0.0 109.836 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.635 HG12 HG13 ' A' ' 85' ' ' ILE . 99.3 t -55.98 -32.85 34.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.481 -0.762 . . . . 0.0 110.324 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.514 ' OG ' HG23 ' A' ' 85' ' ' ILE . 1.1 t -81.56 -41.81 21.05 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.239 -0.913 . . . . 0.0 110.27 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -55.12 -54.18 46.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.0 109.961 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.483 ' HG2' ' HE2' ' A' ' 57' ' ' MET . 11.1 tt0 -54.18 -39.46 66.62 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.408 -0.807 . . . . 0.0 109.657 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.554 ' SG ' HD11 ' A' ' 134' ' ' LEU . 0.1 OUTLIER -55.26 -43.01 74.27 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.318 -0.864 . . . . 0.0 109.644 179.527 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -68.12 -31.22 70.66 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.435 -0.791 . . . . 0.0 109.704 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -75.62 -19.84 58.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.432 -0.793 . . . . 0.0 109.798 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -122.07 40.67 3.59 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.411 -0.806 . . . . 0.0 110.033 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.458 ' O ' ' HB2' ' A' ' 104' ' ' GLN . 0.2 OUTLIER -56.15 -22.64 29.92 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.27 -0.894 . . . . 0.0 110.343 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.443 ' N ' ' HG2' ' A' ' 100' ' ' MET . 2.3 m-30 -76.57 -32.26 58.06 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -0.916 . . . . 0.0 110.256 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.816 ' O ' HG22 ' A' ' 105' ' ' THR . . . -74.5 -39.41 62.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 110.219 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.733 HG23 ' CE ' ' A' ' 81' ' ' MET . 3.2 p -74.26 -42.43 50.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 O-C-N 121.287 -0.883 . . . . 0.0 109.304 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.568 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 67.3 mt-30 -71.94 -20.16 61.8 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.596 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.816 HG22 ' O ' ' A' ' 102' ' ' ALA . 5.1 t -53.34 -28.28 27.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.951 -1.093 . . . . 0.0 110.056 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 1.022 HD11 HD22 ' A' ' 64' ' ' LEU . 75.5 mt -71.94 -35.32 69.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.874 . . . . 0.0 110.263 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.511 ' HA ' ' HG2' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -53.98 -25.94 23.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.234 -0.916 . . . . 0.0 110.087 179.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.469 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 53.8 t0 -108.83 -9.56 15.17 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.351 -0.843 . . . . 0.0 110.233 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.497 ' C ' ' CD1' ' A' ' 109' ' ' PHE . 1.6 t80 -68.11 101.0 1.07 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.274 -0.892 . . . . 0.0 110.257 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 15.3 mt-30 -136.33 163.32 30.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.322 -0.862 . . . . 0.0 110.257 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.552 ' C ' HG23 ' A' ' 112' ' ' VAL . 0.2 OUTLIER -172.45 118.2 0.36 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.218 -0.926 . . . . 0.0 110.161 180.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.552 HG23 ' C ' ' A' ' 111' ' ' TYR . 40.8 t -151.9 72.43 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.224 -0.923 . . . . 0.0 110.232 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.432 ' OD2' ' CE1' ' A' ' 111' ' ' TYR . 10.4 m-20 -121.61 -66.94 1.0 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.27 -0.894 . . . . 0.0 110.168 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.467 ' CD ' ' OD1' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -51.74 -48.12 63.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.22 -0.925 . . . . 0.0 110.284 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.467 ' OD1' ' CD ' ' A' ' 114' ' ' ARG . 1.1 m-20 -86.5 -42.9 13.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.283 -0.886 . . . . 0.0 110.181 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.419 ' HA2' HG12 ' A' ' 112' ' ' VAL . . . 78.22 6.25 87.63 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 7.7 ttpt -108.19 124.85 50.9 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.232 -1.158 . . . . 0.0 110.21 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -66.46 92.84 0.21 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.224 -0.923 . . . . 0.0 110.222 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -126.55 0.32 6.86 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.206 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -104.95 26.09 23.36 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.563 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.7 p -88.32 -42.63 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.232 -1.158 . . . . 0.0 110.231 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.563 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.2 m-20 -37.43 -28.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.76 -0.588 . . . . 0.0 110.76 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.756 ' CG1' HG11 ' A' ' 74' ' ' VAL . 7.1 t -85.29 -64.73 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.243 -0.91 . . . . 0.0 110.211 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.511 ' HG2' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -40.6 -36.27 0.57 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.146 -0.971 . . . . 0.0 111.05 -179.467 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.47 ' O ' ' HB3' ' A' ' 128' ' ' LYS . 17.5 mm-40 -81.36 -50.81 9.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.119 -0.988 . . . . 0.0 111.191 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.452 ' HB3' ' SD ' ' A' ' 78' ' ' MET . 0.0 OUTLIER -53.59 -56.78 14.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.075 -1.016 . . . . 0.0 109.73 -179.786 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.571 ' O ' HG23 ' A' ' 131' ' ' VAL . . . -53.78 -41.36 67.16 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.398 -0.814 . . . . 0.0 110.058 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -50.78 -40.7 55.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.125 -0.984 . . . . 0.0 110.175 179.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -65.21 -53.1 49.64 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 110.177 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.788 HD21 ' HG2' ' A' ' 81' ' ' MET . 17.1 tp -48.58 -32.03 7.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.216 -0.928 . . . . 0.0 110.13 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 127' ' ' ALA . 21.4 t -78.73 -35.05 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.391 -0.818 . . . . 0.0 110.106 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.78 -52.71 55.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 0.0 110.185 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 136' ' ' ASP . 1.0 OUTLIER -66.19 -44.6 83.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.3 -0.875 . . . . 0.0 110.186 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.554 HD11 ' SG ' ' A' ' 96' ' ' CYS . 5.9 mt -46.49 -52.91 12.28 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.246 -0.909 . . . . 0.0 110.346 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 -93.45 54.51 2.07 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.292 -0.88 . . . . 0.0 110.418 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.436 ' HB2' ' O ' ' A' ' 133' ' ' LEU . 0.2 OUTLIER -85.57 -18.91 31.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.192 -0.943 . . . . 0.0 110.11 179.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.58 149.2 49.27 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.242 -0.911 . . . . 0.0 110.366 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 139' ' ' ARG . 36.5 t0 -147.42 90.45 1.87 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.307 -0.87 . . . . 0.0 110.065 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 138' ' ' ASP . 0.1 OUTLIER 38.72 -160.02 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.571 -0.706 . . . . 0.0 110.624 179.696 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -126.6 112.75 15.87 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.198 -0.939 . . . . 0.0 110.187 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 15.4 mtm180 -64.72 -45.04 88.23 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.318 -0.864 . . . . 0.0 110.225 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 49.01 84.52 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.27 -0.894 . . . . 0.0 110.177 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -119.56 29.74 7.45 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 0.0 110.194 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 4.8 mtt-85 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.232 -179.941 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . 0.415 ' C ' ' OG ' ' A' ' -2' ' ' SER . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . 0.415 ' OG ' ' C ' ' A' ' -3' ' ' GLY . 0.8 OUTLIER -162.24 130.86 4.17 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.231 -1.158 . . . . 0.0 110.159 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 52.9 m -109.38 39.83 1.99 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.0 110.253 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -112.43 -50.23 2.91 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.316 -0.865 . . . . 0.0 110.206 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.1 ptp -129.05 -30.89 2.17 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.272 -0.893 . . . . 0.0 110.326 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 50.66 86.21 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.142 -0.974 . . . . 0.0 110.112 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -132.08 163.6 28.11 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.31 -0.868 . . . . 0.0 110.191 179.936 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.418 ' C ' ' O ' ' A' ' 3' ' ' THR . 1.2 m -43.3 112.21 0.35 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.194 -0.941 . . . . 0.0 110.143 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.551 ' O ' HD12 ' A' ' 6' ' ' LEU . 2.2 p -97.31 -67.63 0.84 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.235 -0.916 . . . . 0.0 110.279 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.551 HD12 ' O ' ' A' ' 5' ' ' SER . 0.2 OUTLIER -166.8 120.46 1.03 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.282 -0.887 . . . . 0.0 110.284 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -59.31 173.87 0.46 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.259 -0.901 . . . . 0.0 110.243 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.7 174.06 10.69 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.2 -0.937 . . . . 0.0 110.177 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -96.27 71.94 2.81 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.256 -0.902 . . . . 0.0 110.22 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 30.5 mtp -96.15 -82.37 0.39 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 110.165 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -71.13 -40.98 71.07 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.228 -0.92 . . . . 0.0 110.123 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.472 ' OD1' ' NE2' ' A' ' 15' ' ' HIS . 49.6 t-20 -89.18 116.16 27.22 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.27 -0.894 . . . . 0.0 110.133 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.47 HG22 HG22 ' A' ' 14' ' ' VAL . 35.6 mm -110.03 -76.35 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.244 -0.91 . . . . 0.0 110.28 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.47 HG22 HG22 ' A' ' 13' ' ' ILE . 3.2 m -136.46 116.63 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.216 -0.928 . . . . 0.0 110.391 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.472 ' NE2' ' OD1' ' A' ' 12' ' ' ASN . 14.1 m170 -103.81 -61.84 1.38 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.309 -0.869 . . . . 0.0 110.165 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -172.57 89.03 0.09 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.294 -0.879 . . . . 0.0 110.231 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -92.54 167.52 11.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.184 -0.948 . . . . 0.0 110.236 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.4 ' HB2' ' CD2' ' A' ' 46' ' ' LEU . 59.7 p -139.27 -47.06 0.47 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.333 -0.854 . . . . 0.0 110.103 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 50.61 42.94 27.59 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.24 -0.912 . . . . 0.0 110.286 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.559 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -72.46 -42.35 65.07 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.186 -0.946 . . . . 0.0 110.265 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.476 ' HG3' HG12 ' A' ' 22' ' ' ILE . 17.2 pt-20 -43.23 -34.41 1.15 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.257 -0.902 . . . . 0.0 110.01 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.476 HG12 ' HG3' ' A' ' 21' ' ' GLU . 25.0 mm -79.83 -50.24 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.383 -0.823 . . . . 0.0 109.811 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.776 ' O ' HD11 ' A' ' 43' ' ' ILE . 4.1 mptt -48.76 -27.99 3.33 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.281 -0.887 . . . . 0.0 110.096 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.757 HG21 ' HA ' ' A' ' 56' ' ' ILE . 91.6 t -85.42 -33.62 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.263 -0.898 . . . . 0.0 110.014 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -62.87 -43.27 99.24 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.249 -0.907 . . . . 0.0 109.921 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.02 -33.31 61.76 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.484 -0.76 . . . . 0.0 110.061 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.629 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -64.57 -23.17 67.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.333 -0.854 . . . . 0.0 110.13 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.476 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 40.7 p -130.05 75.87 1.68 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.241 -0.912 . . . . 0.0 110.223 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 29.6 t -175.45 -74.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.159 -0.963 . . . . 0.0 110.149 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -127.62 96.03 4.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.463 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 5.5 p-10 -52.52 134.38 44.24 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.934 . . . . 0.0 110.117 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 31' ' ' ASP . 24.4 Cg_exo -58.33 -179.47 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 123.964 1.507 . . . . 0.0 110.306 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.423 ' O ' ' C ' ' A' ' 34' ' ' GLY . 1.7 m95 -60.46 -164.31 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.292 -0.88 . . . . 0.0 110.39 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 33' ' ' TRP . . . 43.15 -148.01 0.74 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -68.56 -178.57 1.94 Allowed 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.938 1.493 . . . . 0.0 110.328 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.3 m -116.53 47.26 1.46 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.284 -0.885 . . . . 0.0 110.215 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.2 m -125.84 81.9 2.02 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.905 . . . . 0.0 110.187 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.408 ' O ' ' N ' ' A' ' 40' ' ' MET . 0.7 OUTLIER -158.42 -172.7 3.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.23 -0.919 . . . . 0.0 110.227 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.885 ' O ' HD12 ' A' ' 43' ' ' ILE . 4.5 tp 46.68 20.11 0.1 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.278 -0.889 . . . . 0.0 110.712 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.408 ' N ' ' O ' ' A' ' 38' ' ' SER . 2.9 mtt -96.71 -43.7 7.43 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.186 -0.946 . . . . 0.0 109.869 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.0 t -67.33 -28.8 68.28 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.334 -0.854 . . . . 0.0 110.374 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.46 ' O ' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -73.4 -50.37 22.17 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.25 -0.906 . . . . 0.0 110.359 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.935 HG21 HD11 ' A' ' 80' ' ' LEU . 20.9 mt -56.34 -36.62 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.234 -0.916 . . . . 0.0 110.272 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.751 ' CB ' HG23 ' A' ' 87' ' ' THR . . . -70.05 -48.49 57.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.064 -1.023 . . . . 0.0 109.486 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.462 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -53.49 -20.68 5.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.047 -1.033 . . . . 0.0 108.995 178.856 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.741 ' HB3' HD11 ' A' ' 56' ' ' ILE . 15.6 mt -81.5 -36.91 28.69 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.499 -0.751 . . . . 0.0 109.884 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.516 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 67.9 p -51.92 -43.42 63.41 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.269 -0.972 . . . . 0.0 109.038 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 93.4 m-85 -45.02 -43.3 9.11 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.433 -0.907 . . . . 0.0 109.399 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 50' ' ' VAL . 0.8 OUTLIER -71.78 90.47 1.09 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.551 -0.718 . . . . 0.0 110.51 179.631 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.02 -58.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.609 178.175 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.544 HG12 ' N ' ' A' ' 52' ' ' ALA . 3.0 t -66.11 -66.26 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.052 -1.03 . . . . 0.0 110.345 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.62 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -35.46 -42.9 0.23 Allowed 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.16 0.505 . . . . 0.0 110.833 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.593 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 32.0 t80 -58.91 -55.16 38.69 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.413 -0.804 . . . . 0.0 110.21 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.7 t -53.92 -28.18 35.34 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.316 -0.865 . . . . 0.0 109.924 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.38 -30.37 37.86 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.297 -0.877 . . . . 0.0 109.997 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.757 ' HA ' HG21 ' A' ' 24' ' ' VAL . 6.7 mt -75.89 -65.8 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.398 -0.814 . . . . 0.0 109.963 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.593 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 89.4 mmm -45.94 -34.49 3.97 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.21 -0.931 . . . . 0.0 109.792 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.6 m -57.7 -63.99 1.05 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.333 -0.854 . . . . 0.0 110.108 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.471 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.4 OUTLIER -57.93 -20.21 35.78 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.946 . . . . 0.0 110.104 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.786 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -79.67 -30.6 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.337 -0.852 . . . . 0.0 109.979 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.56 ' CD1' ' O ' ' A' ' 57' ' ' MET . 21.6 m95 -80.94 -44.74 17.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.162 -0.962 . . . . 0.0 110.162 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.73 -44.37 85.95 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.289 -0.882 . . . . 0.0 109.813 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -73.75 -14.42 61.12 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.0 109.942 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.921 HD22 HD11 ' A' ' 106' ' ' LEU . 10.1 mt -85.0 -19.49 31.94 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.304 -0.872 . . . . 0.0 110.312 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -99.14 34.75 2.06 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.247 -0.908 . . . . 0.0 110.141 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.682 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.2 OUTLIER -73.13 -167.66 0.42 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.377 -0.827 . . . . 0.0 110.225 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.573 ' HA ' ' CZ ' ' A' ' 109' ' ' PHE . 2.4 p-80 -178.64 172.02 1.45 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.183 -0.948 . . . . 0.0 110.274 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.81 -125.5 7.34 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -117.34 -3.61 11.42 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.288 -1.125 . . . . 0.0 110.114 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -87.18 24.17 1.64 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.283 -0.885 . . . . 0.0 110.241 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.551 ' CZ3' ' HA ' ' A' ' 72' ' ' ARG . 21.7 p-90 -52.3 -19.53 2.14 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.251 -0.906 . . . . 0.0 110.12 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.551 ' HA ' ' CZ3' ' A' ' 71' ' ' TRP . 11.8 ptm180 -42.83 -33.18 0.72 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.309 -0.87 . . . . 0.0 110.138 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.425 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 0.6 OUTLIER -68.28 -48.58 64.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.197 -0.939 . . . . 0.0 109.961 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.682 HG23 ' HB2' ' A' ' 66' ' ' ASP . 79.5 t -53.53 -50.78 47.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 0.0 109.978 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.629 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 2.8 t80 -50.42 -58.97 4.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.215 -0.928 . . . . 0.0 109.979 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.476 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 4.9 mttt -56.62 -25.3 52.72 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.363 -0.836 . . . . 0.0 110.09 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.794 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -73.85 -34.19 64.4 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.89 . . . . 0.0 110.207 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.718 ' HE1' HG13 ' A' ' 123' ' ' VAL . 0.4 OUTLIER -65.59 -34.73 78.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.346 -0.846 . . . . 0.0 110.029 179.841 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 44.5 m -67.99 -59.68 3.08 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 110.317 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.935 HD11 HG21 ' A' ' 43' ' ' ILE . 25.6 tp -47.51 -55.1 9.82 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.31 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 1.051 ' HG2' HD21 ' A' ' 130' ' ' LEU . 2.0 tpt -51.3 -35.57 38.4 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.113 -0.992 . . . . 0.0 110.29 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.753 ' HA ' HD12 ' A' ' 85' ' ' ILE . 26.4 tt0 -71.31 -64.86 0.83 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.183 -0.948 . . . . 0.0 110.418 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 1.098 ' CE1' HG21 ' A' ' 87' ' ' THR . 45.3 t80 -43.8 -38.05 3.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.207 -0.933 . . . . 0.0 110.955 -179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.687 HD23 ' HB2' ' A' ' 44' ' ' ALA . 68.8 mt -76.81 -34.36 57.94 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.124 -0.985 . . . . 0.0 110.751 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.016 HD13 HD21 ' A' ' 134' ' ' LEU . 10.6 mt -50.89 -21.2 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.924 -1.11 . . . . 0.0 109.722 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.69 -77.45 0.57 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.232 -0.917 . . . . 0.0 110.156 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 1.098 HG21 ' CE1' ' A' ' 83' ' ' TYR . 13.0 t -61.85 -13.92 28.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.251 -0.906 . . . . 0.0 110.147 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.668 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -88.82 30.9 5.19 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.495 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 71.47 157.15 0.17 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.318 -1.107 . . . . 0.0 110.431 179.961 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -66.95 -7.19 20.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.424 -0.798 . . . . 0.0 110.485 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -73.09 -40.38 65.05 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 0.0 109.714 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.685 HG11 ' CB ' ' A' ' 84' ' ' LEU . 86.8 t -61.09 -35.15 63.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.315 -0.866 . . . . 0.0 109.855 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.4 t -75.51 -43.84 46.87 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.156 -0.965 . . . . 0.0 109.678 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -56.79 -37.5 71.21 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.278 -0.889 . . . . 0.0 109.603 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -65.22 -41.51 94.37 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.348 -0.845 . . . . 0.0 109.288 179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.427 ' SG ' ' HE2' ' A' ' 81' ' ' MET . 4.6 t -54.22 -42.21 69.55 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.333 -0.854 . . . . 0.0 109.236 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.469 ' CE ' ' HB2' ' A' ' 135' ' ' ARG . 0.6 OUTLIER -65.59 -34.17 77.6 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.505 -0.747 . . . . 0.0 109.351 179.283 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -78.77 -13.68 59.68 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.532 -0.73 . . . . 0.0 109.702 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -134.51 35.52 3.18 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.461 -0.774 . . . . 0.0 110.017 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.8 mtm -63.04 -28.44 70.1 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.245 -0.91 . . . . 0.0 110.133 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.47 ' O ' ' HB ' ' A' ' 105' ' ' THR . 44.0 m-85 -63.04 -22.66 67.01 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -0.89 . . . . 0.0 109.935 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.953 ' O ' HG22 ' A' ' 105' ' ' THR . . . -77.56 -41.12 40.07 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.309 -0.869 . . . . 0.0 110.069 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.498 HG13 HD23 ' A' ' 130' ' ' LEU . 3.4 t -74.75 -26.46 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.392 -0.817 . . . . 0.0 109.967 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.485 ' OE1' HG21 ' A' ' 131' ' ' VAL . 17.4 mm100 -85.64 -25.96 26.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.303 -0.873 . . . . 0.0 110.153 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.953 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.5 t -62.19 -23.88 66.87 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.241 -0.912 . . . . 0.0 110.154 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.921 HD11 HD22 ' A' ' 64' ' ' LEU . 13.5 mt -65.03 -40.51 94.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.186 -0.946 . . . . 0.0 110.177 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.409 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 13.7 ttpp -53.34 -29.63 35.02 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.181 -0.949 . . . . 0.0 109.884 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.454 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 1.3 m-20 -84.67 -26.71 27.58 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.351 -0.843 . . . . 0.0 110.015 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.573 ' CZ ' ' HA ' ' A' ' 67' ' ' HIS . 1.2 t80 -61.31 96.73 0.06 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.334 -0.854 . . . . 0.0 110.088 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 108' ' ' ASP . 20.1 mt-30 -128.6 102.87 6.79 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.292 -0.88 . . . . 0.0 110.315 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -146.02 118.69 8.59 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.264 -0.897 . . . . 0.0 110.087 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.693 ' O ' HG12 ' A' ' 112' ' ' VAL . 92.3 t -122.43 23.37 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -0.921 . . . . 0.0 110.285 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.429 ' O ' ' O ' ' A' ' 112' ' ' VAL . 0.8 OUTLIER 52.4 174.76 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.295 -0.878 . . . . 0.0 110.282 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.32 -49.07 70.57 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.213 -0.929 . . . . 0.0 110.461 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.459 ' O ' ' OD1' ' A' ' 115' ' ' ASP . 32.5 p30 -129.94 64.63 1.51 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.083 -1.011 . . . . 0.0 110.541 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -80.14 -153.46 8.7 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.474 ' O ' ' HG2' ' A' ' 119' ' ' GLN . 8.3 tttt -109.05 39.12 2.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.153 -1.204 . . . . 0.0 110.21 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.442 ' C ' ' O ' ' A' ' 117' ' ' LYS . 15.4 t0 39.55 39.58 0.52 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.456 -0.778 . . . . 0.0 110.763 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 117' ' ' LYS . 12.2 mm100 -93.45 -97.72 0.14 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.194 -0.941 . . . . 0.0 110.04 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.437 ' C ' ' O ' ' A' ' 119' ' ' GLN . . . 42.15 27.16 0.4 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.857 -1.297 . . . . 0.0 109.857 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.814 HG22 ' OE1' ' A' ' 125' ' ' GLU . 4.2 p -127.18 -44.48 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 O-C-N 121.091 -1.24 . . . . 0.0 110.376 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.577 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 3.1 m-80 -46.26 -31.41 2.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.213 -0.929 . . . . 0.0 110.258 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.718 HG13 ' HE1' ' A' ' 78' ' ' MET . 2.0 t -83.13 -55.2 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.25 -0.906 . . . . 0.0 110.361 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.42 ' N ' HG12 ' A' ' 123' ' ' VAL . 2.2 tmt_? -47.74 -49.78 27.32 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.009 -1.057 . . . . 0.0 111.073 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.814 ' OE1' HG22 ' A' ' 121' ' ' VAL . 21.4 mt-10 -64.85 -53.22 50.2 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.257 -0.902 . . . . 0.0 111.505 -179.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.629 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -50.13 -45.43 52.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.982 -1.074 . . . . 0.0 110.682 -179.242 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.24 -42.93 83.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.22 -0.925 . . . . 0.0 110.396 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 9.4 tttp -45.9 -55.99 6.01 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.184 -0.948 . . . . 0.0 110.276 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -58.56 -51.1 71.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 0.0 110.333 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 1.051 HD21 ' HG2' ' A' ' 81' ' ' MET . 25.6 tp -46.09 -27.78 1.04 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.246 -0.909 . . . . 0.0 110.316 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.485 HG21 ' OE1' ' A' ' 104' ' ' GLN . 25.6 t -89.87 -33.87 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.208 -0.933 . . . . 0.0 110.284 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.82 -58.26 6.04 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.23 -0.919 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.6 tt -51.63 -39.5 58.2 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.22 -0.925 . . . . 0.0 110.241 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 1.02 HD23 ' O ' ' A' ' 130' ' ' LEU . 2.9 mm? -54.37 -55.56 27.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 110.182 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.469 ' HB2' ' CE ' ' A' ' 97' ' ' LYS . 29.2 ttt-85 -139.79 82.32 1.87 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.228 -0.92 . . . . 0.0 110.196 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.25 -75.05 0.47 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.281 -0.887 . . . . 0.0 110.307 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -55.73 178.35 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.262 -0.899 . . . . 0.0 110.327 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -129.38 71.46 1.44 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.242 -0.911 . . . . 0.0 110.193 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -69.36 -160.06 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.219 -0.925 . . . . 0.0 110.297 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.531 ' O ' HD12 ' A' ' 140' ' ' LEU . 1.4 pp -102.07 24.17 10.49 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.151 -0.968 . . . . 0.0 110.221 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.55 104.25 0.09 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.134 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.61 177.24 6.4 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.189 -0.944 . . . . 0.0 110.37 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.71 164.93 0.07 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.286 -0.884 . . . . 0.0 110.277 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 51.3 ttt180 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.144 179.952 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.28 -69.31 0.74 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.239 -1.154 . . . . 0.0 110.18 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 2.2 t -112.34 79.5 1.23 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.258 -0.901 . . . . 0.0 110.159 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . 0.442 ' O ' ' CB ' ' A' ' 1' ' ' MET . 3.4 ttt180 -171.81 133.42 0.75 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.206 -0.934 . . . . 0.0 110.3 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.442 ' CB ' ' O ' ' A' ' 0' ' ' ARG . 0.0 OUTLIER 64.62 9.99 5.57 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.196 -0.94 . . . . 0.0 110.235 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -131.47 40.27 3.43 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.296 -0.877 . . . . 0.0 110.19 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 58.4 m -97.34 83.88 3.37 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.33 -0.857 . . . . 0.0 110.261 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.8 p -51.09 167.51 0.08 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.199 -0.938 . . . . 0.0 110.191 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.0 m -135.82 167.39 21.26 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.231 -0.918 . . . . 0.0 110.156 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.73 117.49 34.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.249 -0.907 . . . . 0.0 110.197 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.8 ttm180 -122.14 132.54 54.52 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.246 -0.909 . . . . 0.0 110.222 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -164.92 141.15 5.73 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.251 -0.905 . . . . 0.0 110.214 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.37 25.19 2.66 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -0.921 . . . . 0.0 110.241 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 60.1 mtt -117.77 152.91 34.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.301 -0.874 . . . . 0.0 110.229 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 mmtp -92.87 -77.26 0.45 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.241 -0.912 . . . . 0.0 110.186 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.401 ' C ' HG13 ' A' ' 13' ' ' ILE . 2.7 m-80 -179.85 50.16 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.276 -0.89 . . . . 0.0 110.164 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.956 HG22 HG23 ' A' ' 14' ' ' VAL . 4.7 mt -124.32 141.42 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.291 -0.88 . . . . 0.0 110.219 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.956 HG23 HG22 ' A' ' 13' ' ' ILE . 4.6 t 41.89 82.12 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.38 -0.825 . . . . 0.0 110.289 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 5.1 t-160 -113.53 67.15 0.67 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.242 -0.912 . . . . 0.0 110.142 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.408 ' OD1' ' C ' ' A' ' 16' ' ' ASN . 35.3 p30 -108.4 178.66 4.43 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.297 -0.877 . . . . 0.0 110.186 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.451 ' O ' ' HB2' ' A' ' 18' ' ' SER . 74.1 m-85 -67.68 124.13 22.43 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.297 -0.877 . . . . 0.0 110.246 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 17' ' ' TYR . 43.5 t -179.2 37.82 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.306 -0.871 . . . . 0.0 110.177 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -108.22 2.06 22.52 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.245 -0.909 . . . . 0.0 110.305 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.76 ' HA ' HD13 ' A' ' 46' ' ' LEU . . . -64.67 -44.52 90.1 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.266 -0.896 . . . . 0.0 110.178 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.402 ' HG3' HG12 ' A' ' 22' ' ' ILE . 11.1 pt-20 -55.52 -42.87 75.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.177 -0.952 . . . . 0.0 110.292 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.402 HG12 ' HG3' ' A' ' 21' ' ' GLU . 25.1 mm -63.68 -53.87 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.288 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HB3' HG13 ' A' ' 43' ' ' ILE . 28.7 mmtm -50.74 -58.97 4.62 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.207 -0.933 . . . . 0.0 110.349 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.91 HG21 ' HA ' ' A' ' 56' ' ' ILE . 38.2 t -45.0 -44.52 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.0 110.447 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -38.64 91.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.118 -0.989 . . . . 0.0 110.334 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -72.03 -20.66 61.66 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.322 -0.861 . . . . 0.0 110.055 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.758 ' HB2' HD23 ' A' ' 39' ' ' LEU . . . -86.81 -15.94 37.7 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.198 -0.939 . . . . 0.0 110.05 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.505 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 14.0 p -112.1 44.29 1.44 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.33 -0.856 . . . . 0.0 110.102 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.2 m -169.38 -165.42 0.52 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.286 -0.884 . . . . 0.0 110.171 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.415 ' ND2' ' N ' ' A' ' 30' ' ' ASN . 1.5 p30 -149.57 57.51 0.99 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.278 -0.888 . . . . 0.0 110.23 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.568 ' N ' ' HD2' ' A' ' 32' ' ' PRO . 0.3 OUTLIER -62.8 -50.27 78.36 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.256 -0.903 . . . . 0.0 110.589 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 31' ' ' ASP . 35.8 Cg_endo -73.58 170.91 18.87 Favored 'Trans proline' 0 C--N 1.309 -1.53 0 O-C-N 123.727 1.383 . . . . 0.0 110.423 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -60.27 -87.06 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.225 -0.922 . . . . 0.0 110.707 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.88 -164.12 6.61 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -62.87 -170.38 0.1 OUTLIER 'Trans proline' 0 C--N 1.305 -1.755 0 O-C-N 124.053 1.554 . . . . 0.0 110.339 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.7 m -95.02 161.97 13.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.202 -0.936 . . . . 0.0 110.19 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.2 m -93.41 86.41 5.26 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.268 -0.895 . . . . 0.0 110.229 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.14 77.89 0.27 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.159 -0.963 . . . . 0.0 110.159 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.758 HD23 ' HB2' ' A' ' 27' ' ' ALA . 1.6 tp -118.26 -33.16 4.46 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.28 -0.888 . . . . 0.0 110.209 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.82 -60.68 3.41 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.221 -0.925 . . . . 0.0 110.264 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.564 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 14.1 m -46.87 -28.29 1.53 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.202 -0.936 . . . . 0.0 110.216 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HB3' ' O ' ' A' ' 39' ' ' LEU . 19.5 tp10 -71.92 -50.74 26.51 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.305 -0.872 . . . . 0.0 110.249 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.596 HG21 HD11 ' A' ' 80' ' ' LEU . 8.1 mt -54.91 -31.46 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.137 -0.977 . . . . 0.0 110.03 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.537 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.48 -53.4 16.42 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.248 -0.908 . . . . 0.0 109.547 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.523 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER -53.15 -20.88 4.28 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.02 -1.05 . . . . 0.0 109.044 179.112 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.809 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 11.0 mt -80.66 -37.16 31.4 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.522 -0.736 . . . . 0.0 110.108 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.63 HG21 HG21 ' A' ' 92' ' ' VAL . 68.8 p -53.54 -43.14 68.17 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.031 -1.043 . . . . 0.0 109.29 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.523 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 92.6 m-85 -43.57 -41.23 4.43 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.394 -0.816 . . . . 0.0 109.523 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.536 ' O ' ' N ' ' A' ' 51' ' ' VAL . 0.5 OUTLIER -74.69 93.1 2.51 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.427 -0.796 . . . . 0.0 110.247 179.459 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.532 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.42 -57.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.535 178.262 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.541 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.8 t -64.48 -65.69 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.018 -1.051 . . . . 0.0 110.359 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.809 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.84 -48.87 1.16 Allowed 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.051 -177.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.573 ' HA ' HD12 ' A' ' 56' ' ' ILE . 2.6 t80 -55.15 -53.32 57.46 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.198 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 58' ' ' SER . 1.1 t -57.41 -26.31 60.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.179 -0.951 . . . . 0.0 110.416 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -87.58 -20.45 26.4 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.171 -0.955 . . . . 0.0 110.492 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.91 ' HA ' HG21 ' A' ' 24' ' ' VAL . 10.8 mt -78.99 -70.09 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.192 -0.942 . . . . 0.0 110.316 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.511 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 9.6 mtp -50.92 -36.79 40.24 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.174 -0.954 . . . . 0.0 109.897 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.482 ' HB2' ' O ' ' A' ' 54' ' ' SER . 42.3 t -54.37 -59.99 3.95 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.274 -0.891 . . . . 0.0 109.761 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.42 ' HA ' ' HD3' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -58.83 -28.9 66.48 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.336 -0.852 . . . . 0.0 109.587 179.488 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.768 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -66.99 -31.65 54.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.458 -0.776 . . . . 0.0 109.624 179.699 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.55 ' CH2' ' HE3' ' A' ' 81' ' ' MET . 41.6 m95 -76.04 -47.41 24.86 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.183 -0.948 . . . . 0.0 110.191 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.42 ' HD3' ' HA ' ' A' ' 59' ' ' MET . 5.9 mttt -49.86 -61.9 1.87 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.347 -0.845 . . . . 0.0 110.393 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.455 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 20.4 mmt-85 -64.27 -19.84 65.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.244 -0.91 . . . . 0.0 110.19 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.994 ' CD2' HD11 ' A' ' 106' ' ' LEU . 3.2 mt -70.73 -20.41 62.64 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.169 -0.957 . . . . 0.0 110.332 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.553 ' O ' ' CD2' ' A' ' 67' ' ' HIS . 10.3 m-20 -106.63 38.02 2.17 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.188 -0.945 . . . . 0.0 110.218 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.601 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.7 OUTLIER -61.0 140.6 57.79 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.293 -0.879 . . . . 0.0 110.14 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.553 ' CD2' ' O ' ' A' ' 65' ' ' ASN . 91.1 m-70 -124.32 -179.82 4.61 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.457 -0.777 . . . . 0.0 110.191 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 70.32 -105.47 1.59 Allowed Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.444 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 2.3 ttpt -140.59 72.27 1.39 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.239 -1.153 . . . . 0.0 110.149 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.402 ' HB3' ' OD2' ' A' ' 66' ' ' ASP . 0.5 OUTLIER -151.43 29.61 0.62 Allowed 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.381 -0.825 . . . . 0.0 110.287 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.577 ' CZ3' ' HG3' ' A' ' 72' ' ' ARG . 46.1 p-90 -54.47 -17.72 3.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.242 -0.912 . . . . 0.0 110.308 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.577 ' HG3' ' CZ3' ' A' ' 71' ' ' TRP . 0.9 OUTLIER -53.75 -42.01 67.73 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.208 -0.933 . . . . 0.0 110.232 179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -66.05 -39.81 90.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.2 -0.938 . . . . 0.0 110.244 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.73 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 9.6 t -55.49 -57.12 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.178 -0.951 . . . . 0.0 110.175 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.625 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 17.3 t80 -48.77 -66.77 0.34 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.221 -0.924 . . . . 0.0 110.019 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.505 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.3 OUTLIER -49.22 -25.29 2.18 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.366 -0.834 . . . . 0.0 109.963 179.851 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.826 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -67.75 -50.71 55.82 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.278 -0.889 . . . . 0.0 110.172 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.758 ' SD ' HD21 ' A' ' 64' ' ' LEU . 3.2 mpp? -54.91 -29.79 56.83 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.358 -0.839 . . . . 0.0 110.198 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.402 ' O ' ' HB3' ' A' ' 82' ' ' GLU . 2.6 m -67.59 -53.88 24.47 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.355 -0.841 . . . . 0.0 110.527 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.768 ' CD2' HD11 ' A' ' 60' ' ' ILE . 21.0 tp -55.84 -53.33 58.04 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.224 -0.922 . . . . 0.0 110.106 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.776 ' SD ' HD21 ' A' ' 130' ' ' LEU . 0.4 OUTLIER -55.0 -24.99 26.95 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.095 -1.003 . . . . 0.0 110.446 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.687 ' HB2' HD12 ' A' ' 130' ' ' LEU . 2.8 tt0 -79.37 -59.44 2.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.066 -1.021 . . . . 0.0 110.436 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.586 ' CE1' HG21 ' A' ' 87' ' ' THR . 17.8 t80 -53.45 -31.35 45.11 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.423 -0.798 . . . . 0.0 111.013 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.823 ' CB ' HG11 ' A' ' 92' ' ' VAL . 73.9 mt -77.87 -29.98 50.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.218 -0.926 . . . . 0.0 110.638 -179.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.878 HD13 HD11 ' A' ' 134' ' ' LEU . 26.5 mt -64.09 -11.59 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.087 -1.008 . . . . 0.0 109.974 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -107.43 -72.35 0.72 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.27 -0.894 . . . . 0.0 110.168 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.586 HG21 ' CE1' ' A' ' 83' ' ' TYR . 12.2 t -89.16 1.3 55.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.15 -0.969 . . . . 0.0 110.189 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.613 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -91.35 28.1 8.62 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.259 -1.536 . . . . 0.0 109.259 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.5 OUTLIER 75.06 149.29 0.1 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.562 -0.964 . . . . 0.0 110.114 -179.822 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.74 -10.3 12.33 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.391 -0.818 . . . . 0.0 110.635 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 73.8 mtp85 -70.32 -45.82 65.46 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.059 -1.026 . . . . 0.0 109.647 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.823 HG11 ' CB ' ' A' ' 84' ' ' LEU . 96.9 t -52.56 -30.94 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 O-C-N 121.488 -0.758 . . . . 0.0 110.039 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.548 ' OG ' HD21 ' A' ' 134' ' ' LEU . 21.0 t -81.23 -37.39 28.66 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.323 -0.861 . . . . 0.0 109.884 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.409 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 24.4 mm-40 -56.61 -52.55 64.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -0.873 . . . . 0.0 109.927 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.443 ' HB3' ' SD ' ' A' ' 57' ' ' MET . 7.0 tp60 -57.26 -36.95 71.61 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.465 -0.772 . . . . 0.0 109.594 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.6 t -57.22 -39.64 75.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.272 -0.892 . . . . 0.0 109.651 179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -71.79 -30.3 65.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.497 -0.752 . . . . 0.0 109.66 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 61.9 mt-10 -83.94 -11.83 56.27 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.453 -0.779 . . . . 0.0 110.029 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -128.41 32.08 4.91 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.375 -0.828 . . . . 0.0 110.133 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.4 ppp? -63.9 -20.44 65.85 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.263 -0.898 . . . . 0.0 110.118 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.484 ' O ' ' HB ' ' A' ' 105' ' ' THR . 31.6 m-85 -75.97 -20.85 57.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.277 -0.889 . . . . 0.0 110.274 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.951 ' O ' HG22 ' A' ' 105' ' ' THR . . . -85.72 -39.85 16.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.155 -0.966 . . . . 0.0 110.106 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.618 HG11 HG22 ' A' ' 131' ' ' VAL . 3.6 p -73.93 -41.91 53.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.637 0 CA-C-O 122.033 0.92 . . . . 0.0 109.141 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.568 ' N ' ' CG1' ' A' ' 103' ' ' VAL . 3.7 mm-40 -69.42 -24.51 63.85 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.68 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 102' ' ' ALA . 5.0 t -59.53 -27.77 66.48 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.953 -1.092 . . . . 0.0 109.932 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.994 HD11 ' CD2' ' A' ' 64' ' ' LEU . 61.8 mt -59.44 -37.74 78.89 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.324 -0.86 . . . . 0.0 110.144 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.413 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 34.8 ttpt -45.93 -32.41 2.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.021 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -94.94 -27.19 15.8 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.381 -0.825 . . . . 0.0 110.075 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.476 ' CZ ' ' O ' ' A' ' 66' ' ' ASP . 3.0 t80 -44.64 118.12 1.49 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.316 -0.865 . . . . 0.0 110.24 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -156.57 165.09 37.27 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.313 -0.867 . . . . 0.0 110.156 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -165.95 114.86 0.97 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.251 -0.906 . . . . 0.0 110.286 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.683 HG13 ' N ' ' A' ' 117' ' ' LYS . 19.3 t -140.85 78.23 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.206 -0.933 . . . . 0.0 110.339 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -110.06 -89.91 0.48 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.272 -0.893 . . . . 0.0 110.085 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.7 ptt-85 -52.11 -48.31 64.84 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.287 -0.883 . . . . 0.0 110.254 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -63.07 -82.03 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.313 -0.867 . . . . 0.0 110.129 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.444 ' C ' ' CG1' ' A' ' 112' ' ' VAL . . . 123.3 10.51 5.54 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.683 ' N ' HG13 ' A' ' 112' ' ' VAL . 0.4 OUTLIER -133.63 144.83 49.49 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.267 -1.137 . . . . 0.0 110.201 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -45.42 130.74 8.51 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.273 -0.892 . . . . 0.0 110.164 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -44.15 -77.55 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.23 -0.919 . . . . 0.0 110.252 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -161.26 151.86 22.28 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.54 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.0 p -93.28 -41.09 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.347 -1.09 . . . . 0.0 110.149 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.54 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 15.3 m-20 -36.36 -29.1 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.877 -0.514 . . . . 0.0 111.022 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.606 HG13 ' CG1' ' A' ' 74' ' ' VAL . 12.0 t -73.72 -64.72 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.122 -0.986 . . . . 0.0 110.358 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.413 ' HG3' ' HA ' ' A' ' 107' ' ' LYS . 35.5 ttp180 -51.96 -31.25 28.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.256 -0.902 . . . . 0.0 110.77 -179.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.467 ' HG3' HG22 ' A' ' 121' ' ' VAL . 11.5 mt-10 -76.31 -46.98 25.25 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.173 -0.955 . . . . 0.0 110.617 -179.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.625 ' CG ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -55.43 -49.71 71.7 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.99 . . . . 0.0 110.257 -179.763 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.564 ' CA ' ' HG2' ' A' ' 78' ' ' MET . . . -66.33 -41.31 89.78 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.305 -0.872 . . . . 0.0 110.712 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.01 -34.25 73.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.178 -0.951 . . . . 0.0 110.762 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -77.67 -28.54 51.17 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.183 -0.948 . . . . 0.0 110.861 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.776 HD21 ' SD ' ' A' ' 81' ' ' MET . 5.1 tt -68.74 -48.0 64.89 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.134 -0.979 . . . . 0.0 110.282 -179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.618 HG22 HG11 ' A' ' 103' ' ' VAL . 5.3 t -69.4 -28.18 37.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.261 -0.899 . . . . 0.0 110.137 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.48 -47.12 57.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.852 . . . . 0.0 110.432 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.98 -33.56 70.82 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.18 -0.95 . . . . 0.0 110.4 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.878 HD11 HD13 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -73.24 -65.36 0.82 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.168 -0.958 . . . . 0.0 110.425 -179.929 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -92.03 40.05 1.03 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.202 -0.936 . . . . 0.0 110.305 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.416 ' O ' ' O ' ' A' ' 137' ' ' GLU . 10.6 t0 -62.15 -19.15 62.75 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.244 -0.91 . . . . 0.0 110.161 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.416 ' O ' ' O ' ' A' ' 136' ' ' ASP . 0.4 OUTLIER -56.93 -164.09 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.167 -0.958 . . . . 0.0 110.048 179.94 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 55.48 95.27 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.152 -0.968 . . . . 0.0 110.244 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -55.13 156.76 3.81 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.209 -0.932 . . . . 0.0 110.296 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.12 133.25 42.67 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.121 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 7.5 mtt-85 -53.76 158.11 2.08 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.24 -0.913 . . . . 0.0 110.211 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -169.53 144.85 3.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.193 -0.942 . . . . 0.0 110.263 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -138.69 144.45 39.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.304 -0.872 . . . . 0.0 110.135 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 25.9 ttt180 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.171 179.949 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.382 0 N-CA-C 109.564 -1.415 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . 0.425 ' O ' ' CB ' ' A' ' -1' ' ' SER . 19.7 m -146.6 89.57 1.85 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.286 -1.126 . . . . 0.0 110.252 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . 0.425 ' CB ' ' O ' ' A' ' -2' ' ' SER . 0.9 OUTLIER 64.4 -161.45 0.28 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.241 -0.912 . . . . 0.0 110.236 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -144.64 137.84 26.93 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.249 -0.907 . . . . 0.0 110.269 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 ttp -95.72 162.8 13.45 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.186 -0.946 . . . . 0.0 110.132 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -136.18 172.24 13.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.237 -0.914 . . . . 0.0 110.226 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.77 161.56 37.77 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.242 -0.912 . . . . 0.0 110.306 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.6 -172.81 2.16 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.247 -0.908 . . . . 0.0 110.251 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.42 -143.3 0.23 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.269 -0.894 . . . . 0.0 110.228 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.2 tp -142.52 -72.03 0.32 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.258 -0.901 . . . . 0.0 110.203 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -135.72 171.14 14.89 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.217 -0.927 . . . . 0.0 110.238 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.3 mtm-85 -47.39 -67.97 0.23 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.26 -0.9 . . . . 0.0 110.259 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -135.31 179.73 6.15 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.2 -0.938 . . . . 0.0 110.226 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 44.2 mtt -124.34 -165.54 1.38 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.192 -0.942 . . . . 0.0 110.025 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -44.57 158.14 0.06 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.191 -0.943 . . . . 0.0 110.016 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.458 ' O ' ' HB ' ' A' ' 13' ' ' ILE . 27.4 t30 -155.77 -37.95 0.08 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.23 -0.918 . . . . 0.0 110.308 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.458 ' HB ' ' O ' ' A' ' 12' ' ' ASN . 2.0 mt 60.07 124.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.288 -0.882 . . . . 0.0 110.251 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.443 ' O ' HG13 ' A' ' 14' ' ' VAL . 5.2 p -101.49 133.25 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.201 -0.937 . . . . 0.0 110.394 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -145.76 28.39 1.16 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.341 -0.849 . . . . 0.0 110.096 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -84.81 -141.27 0.08 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.265 -0.897 . . . . 0.0 110.345 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.479 ' O ' ' CB ' ' A' ' 18' ' ' SER . 43.6 p90 -77.05 140.86 40.44 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.286 -0.884 . . . . 0.0 110.368 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.479 ' CB ' ' O ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER 169.81 52.1 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.298 -0.876 . . . . 0.0 109.958 179.879 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.429 ' O ' ' HB ' ' A' ' 22' ' ' ILE . 50.7 mt-10 -103.49 7.86 37.85 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.173 -0.954 . . . . 0.0 110.491 -179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.785 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -56.86 -54.59 44.71 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.156 -0.965 . . . . 0.0 110.129 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' A' ' 20' ' ' ALA . 5.7 pt-20 -43.75 -26.49 0.25 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.095 -1.003 . . . . 0.0 109.975 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 19' ' ' GLU . 21.5 mm -77.72 -49.01 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.293 -0.879 . . . . 0.0 110.074 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.67 -42.94 75.83 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.296 -0.878 . . . . 0.0 110.138 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.717 HG13 ' CD2' ' A' ' 80' ' ' LEU . 78.4 t -65.43 -41.96 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.249 -0.907 . . . . 0.0 110.048 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -50.42 -44.86 55.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.197 -0.939 . . . . 0.0 110.159 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -79.04 -26.98 43.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.382 -0.824 . . . . 0.0 110.188 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.795 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -64.42 -23.06 67.16 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.166 -0.959 . . . . 0.0 110.197 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 28.4 p -118.9 68.87 0.8 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 110.178 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -161.99 -73.73 0.05 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 110.174 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -175.98 135.81 0.29 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.349 -0.845 . . . . 0.0 110.084 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -165.36 121.77 1.03 Allowed Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.235 -0.916 . . . . 0.0 110.21 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.428 ' O ' ' O ' ' A' ' 33' ' ' TRP . 27.9 Cg_exo -56.96 -163.05 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 123.855 1.45 . . . . 0.0 110.26 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.428 ' O ' ' O ' ' A' ' 32' ' ' PRO . 0.6 OUTLIER -57.23 -160.06 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.272 -0.893 . . . . 0.0 110.536 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 166.19 77.59 0.03 OUTLIER Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -66.49 -22.55 51.57 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.977 1.514 . . . . 0.0 110.372 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.2 t -74.0 -152.09 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.202 -0.936 . . . . 0.0 110.276 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.8 m -54.53 161.98 1.28 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.286 -0.884 . . . . 0.0 110.242 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.59 123.48 49.01 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.246 -0.909 . . . . 0.0 110.128 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.795 HD21 ' HB2' ' A' ' 27' ' ' ALA . 1.1 tp -50.97 -28.71 10.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.269 -0.894 . . . . 0.0 110.122 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 3.9 mtm -70.11 -43.42 71.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.193 -0.942 . . . . 0.0 110.152 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.44 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 0.1 OUTLIER -60.6 -35.56 76.42 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.286 -0.884 . . . . 0.0 110.129 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -73.51 -39.55 64.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.274 -0.891 . . . . 0.0 110.121 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.792 HG21 HD11 ' A' ' 80' ' ' LEU . 67.8 mt -64.79 -33.15 61.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 0.0 109.968 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.631 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -74.58 -48.64 25.51 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.213 -0.929 . . . . 0.0 108.956 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.402 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 6.3 m-20 -52.7 -23.03 5.89 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.785 HD22 ' HB2' ' A' ' 20' ' ' ALA . 9.9 mt -77.3 -39.57 47.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.831 -0.543 . . . . 0.0 109.942 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.537 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 81.0 p -48.79 -42.85 37.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.103 -0.998 . . . . 0.0 109.037 179.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.579 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 75.3 m-85 -45.05 -47.66 11.79 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.196 -0.94 . . . . 0.0 109.199 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.533 ' O ' ' C ' ' A' ' 50' ' ' VAL . 2.3 m-80 -66.88 89.83 0.17 Allowed 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 121.46 0.648 . . . . 0.0 110.421 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.533 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.19 -59.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.681 178.331 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.542 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.7 t -64.57 -65.09 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.157 -0.964 . . . . 0.0 110.424 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.622 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -36.52 -43.63 0.4 Allowed 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.149 0.5 . . . . 0.0 111.173 -177.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.623 ' HA ' HD12 ' A' ' 56' ' ' ILE . 6.5 t80 -58.99 -58.11 10.1 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.242 -0.911 . . . . 0.0 110.454 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.8 t -51.42 -36.0 41.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.258 -0.901 . . . . 0.0 110.46 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.9 -28.9 60.82 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.304 -0.873 . . . . 0.0 110.402 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.686 HD11 ' HB3' ' A' ' 46' ' ' LEU . 22.2 mt -73.03 -70.01 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -0.89 . . . . 0.0 110.472 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.54 ' HE1' ' CZ2' ' A' ' 61' ' ' TRP . 65.2 mmm -46.14 -36.35 5.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.096 -1.003 . . . . 0.0 110.021 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.5 m -53.83 -63.84 1.02 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.325 -0.86 . . . . 0.0 110.197 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -56.9 -31.44 64.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.066 -1.021 . . . . 0.0 109.478 179.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.668 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.8 OUTLIER -63.15 -34.12 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.467 -0.771 . . . . 0.0 109.852 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.54 ' CZ2' ' HE1' ' A' ' 57' ' ' MET . 34.6 m95 -78.15 -29.33 48.65 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.186 -0.946 . . . . 0.0 110.186 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -58.74 7.09 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.243 -0.911 . . . . 0.0 110.197 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.484 ' HB3' ' HB3' ' A' ' 73' ' ' HIS . 2.8 mtt180 -71.04 -15.62 62.56 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.279 -0.888 . . . . 0.0 110.127 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.696 HD22 HD11 ' A' ' 106' ' ' LEU . 13.5 mt -80.73 -8.33 59.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.354 -0.841 . . . . 0.0 110.581 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -82.29 26.47 0.54 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.238 -0.914 . . . . 0.0 111.223 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.579 ' OD1' ' CG ' ' A' ' 109' ' ' PHE . 6.2 m-20 52.92 174.87 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.335 -0.853 . . . . 0.0 110.806 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.479 ' HB3' ' HB2' ' A' ' 70' ' ' ASN . 0.2 OUTLIER -170.32 170.32 7.21 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.693 -0.629 . . . . 0.0 109.868 179.753 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -52.78 -88.14 0.01 OUTLIER Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.484 ' CG ' ' O ' ' A' ' 69' ' ' LYS . 12.5 tttt -111.14 58.52 0.62 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.256 -1.143 . . . . 0.0 109.995 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.479 ' HB2' ' HB3' ' A' ' 67' ' ' HIS . 50.1 m-80 -145.16 16.37 1.53 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.258 -0.902 . . . . 0.0 110.164 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.524 ' CH2' ' HG2' ' A' ' 72' ' ' ARG . 44.0 p-90 -48.07 -25.2 1.33 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.258 -0.901 . . . . 0.0 110.236 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.524 ' HG2' ' CH2' ' A' ' 71' ' ' TRP . 38.7 mtt180 -49.24 -48.04 46.02 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.217 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 63' ' ' ARG . 30.1 m170 -54.19 -47.75 71.72 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.267 -0.896 . . . . 0.0 110.176 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.724 ' O ' ' HB3' ' A' ' 77' ' ' ALA . 47.1 t -47.96 -50.4 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.257 -0.902 . . . . 0.0 110.206 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -52.6 -61.36 2.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.225 -0.922 . . . . 0.0 109.94 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.472 ' HE2' ' O ' ' A' ' 72' ' ' ARG . 8.5 mtmm -52.32 -23.17 5.4 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.239 -0.913 . . . . 0.0 109.476 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' A' ' 74' ' ' VAL . . . -70.91 -46.54 62.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.344 -0.848 . . . . 0.0 109.909 179.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.766 ' HE2' HG23 ' A' ' 123' ' ' VAL . 0.1 OUTLIER -53.19 -37.62 62.11 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.451 -0.781 . . . . 0.0 109.967 179.886 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.483 ' O ' ' HB3' ' A' ' 82' ' ' GLU . 1.9 m -62.86 -63.09 1.31 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.191 -0.943 . . . . 0.0 110.15 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.792 HD11 HG21 ' A' ' 43' ' ' ILE . 15.3 tp -44.86 -69.55 0.13 Allowed 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.199 -0.938 . . . . 0.0 109.39 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.551 ' HE2' HD11 ' A' ' 64' ' ' LEU . 6.5 ttp -39.09 -35.96 0.27 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.495 -0.753 . . . . 0.0 110.811 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.843 ' HB2' HD11 ' A' ' 130' ' ' LEU . 1.6 tm-20 -69.54 -66.16 0.62 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.011 -1.056 . . . . 0.0 110.247 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.559 ' CE1' HG21 ' A' ' 87' ' ' THR . 24.1 t80 -41.76 -48.81 4.32 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.237 -0.914 . . . . 0.0 110.841 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.746 HD11 HD11 ' A' ' 80' ' ' LEU . 7.5 mt -59.85 -48.48 81.52 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.084 -1.01 . . . . 0.0 110.278 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.664 HD12 HD21 ' A' ' 130' ' ' LEU . 76.0 mt -55.08 -23.37 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.189 -0.945 . . . . 0.0 110.008 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -87.73 -77.44 0.35 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.24 -0.912 . . . . 0.0 110.146 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.559 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.9 t -89.64 -20.56 23.54 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 110.258 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.631 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -43.74 -73.93 0.23 Allowed Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.3 OUTLIER 172.32 175.09 0.09 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.194 -1.18 . . . . 0.0 110.223 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 25.8 mt-10 -73.65 -16.81 61.21 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.235 -0.916 . . . . 0.0 110.168 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 1.8 mtp180 -76.57 -35.09 58.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.252 -0.905 . . . . 0.0 110.05 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.555 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 69.9 t -63.06 -51.92 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.211 -0.931 . . . . 0.0 110.053 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.5 p -61.37 -43.2 99.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.199 -0.938 . . . . 0.0 109.993 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.466 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 6.4 mm-40 -53.18 -49.45 66.67 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.229 -0.919 . . . . 0.0 109.815 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.466 ' OE1' ' CB ' ' A' ' 57' ' ' MET . 5.2 tt0 -55.35 -44.01 75.57 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.489 -0.757 . . . . 0.0 109.62 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -43.21 62.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.336 -0.853 . . . . 0.0 109.432 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -66.73 -35.36 79.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.752 . . . . 0.0 109.829 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 19.7 mt-10 -78.62 -11.06 59.95 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.362 -0.836 . . . . 0.0 109.887 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -136.21 38.45 2.73 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.356 -0.84 . . . . 0.0 110.068 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 3.5 mtp -62.76 -33.29 74.85 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.286 -0.884 . . . . 0.0 110.221 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.459 ' O ' ' HB ' ' A' ' 105' ' ' THR . 4.2 m-30 -59.99 -21.12 60.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.322 -0.861 . . . . 0.0 110.039 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.9 ' O ' HG22 ' A' ' 105' ' ' THR . . . -81.87 -42.68 19.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.347 -0.845 . . . . 0.0 110.139 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.563 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.5 t -75.22 -19.59 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.38 -0.825 . . . . 0.0 109.927 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -91.89 -32.17 15.4 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.291 -0.881 . . . . 0.0 110.115 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.9 HG22 ' O ' ' A' ' 102' ' ' ALA . 14.7 t -58.15 -23.82 56.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.314 -0.866 . . . . 0.0 109.873 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.696 HD11 HD22 ' A' ' 64' ' ' LEU . 11.4 mt -69.19 -41.07 77.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.319 -0.863 . . . . 0.0 110.041 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 6.2 ttpp -49.39 -28.74 5.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.337 -0.852 . . . . 0.0 110.258 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -99.23 -24.24 14.92 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.279 -0.888 . . . . 0.0 110.359 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.579 ' CG ' ' OD1' ' A' ' 66' ' ' ASP . 2.5 t80 -45.47 118.66 1.83 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.235 -0.915 . . . . 0.0 110.172 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.471 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 0.0 OUTLIER -147.9 148.58 30.98 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.317 -0.864 . . . . 0.0 109.958 179.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.443 ' HB2' ' O ' ' A' ' 110' ' ' GLN . 1.9 t80 -176.91 127.13 0.16 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.063 -1.023 . . . . 0.0 110.242 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.532 ' O ' HG12 ' A' ' 112' ' ' VAL . 21.6 t -131.44 31.0 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.241 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 4.1 t70 60.37 -144.84 0.5 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.264 -0.897 . . . . 0.0 110.159 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -66.6 0.89 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.33 -0.857 . . . . 0.0 109.532 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.42 71.76 0.98 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.543 -0.723 . . . . 0.0 110.206 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.401 ' C ' ' CG1' ' A' ' 112' ' ' VAL . . . -117.47 -164.15 13.19 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.475 ' O ' HG13 ' A' ' 112' ' ' VAL . 4.8 mttt -116.67 160.85 20.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -1.143 . . . . 0.0 110.189 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -76.38 93.17 3.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.206 -0.934 . . . . 0.0 110.348 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -122.76 35.79 4.8 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.178 -0.952 . . . . 0.0 110.213 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.474 ' O ' ' HG3' ' A' ' 124' ' ' ARG . . . -136.89 32.3 2.46 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.558 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.5 p -87.69 -44.22 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.162 -1.199 . . . . 0.0 109.93 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.558 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.5 OUTLIER -45.18 -49.8 11.85 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.421 -0.799 . . . . 0.0 110.104 179.868 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.766 HG23 ' HE2' ' A' ' 78' ' ' MET . 7.1 p -59.49 -37.51 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 0.0 110.384 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.485 ' N ' HG13 ' A' ' 123' ' ' VAL . 14.8 mtm180 -62.75 -68.11 0.36 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.21 -0.931 . . . . 0.0 110.789 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 122' ' ' ASN . 0.0 OUTLIER -52.51 -33.26 44.26 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.311 -0.868 . . . . 0.0 110.96 -179.321 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 122' ' ' ASN . 0.7 OUTLIER -59.56 -55.23 37.18 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.938 -1.101 . . . . 0.0 110.175 -179.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.563 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -53.89 -41.32 67.46 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.235 -0.915 . . . . 0.0 110.44 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.75 -35.66 75.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.247 -0.908 . . . . 0.0 110.421 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -66.72 -50.9 61.29 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.246 -0.909 . . . . 0.0 110.43 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.843 HD11 ' HB2' ' A' ' 82' ' ' GLU . 0.2 OUTLIER -54.11 -29.63 45.6 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.209 -0.932 . . . . 0.0 110.156 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 85.6 t -83.33 -29.6 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.307 -0.871 . . . . 0.0 110.224 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -69.4 -50.9 41.65 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.354 -0.842 . . . . 0.0 110.402 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.757 HD22 ' OD2' ' A' ' 136' ' ' ASP . 0.8 OUTLIER -63.31 -51.44 66.0 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.211 -0.93 . . . . 0.0 110.382 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.704 HD13 ' O ' ' A' ' 130' ' ' LEU . 0.4 OUTLIER -52.23 -39.17 59.93 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.178 -0.951 . . . . 0.0 110.301 -179.989 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.476 ' CG ' ' O ' ' A' ' 135' ' ' ARG . 0.5 OUTLIER -114.05 58.89 0.68 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.115 -0.991 . . . . 0.0 110.244 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.757 ' OD2' HD22 ' A' ' 133' ' ' LEU . 5.6 m-20 -80.36 -59.98 2.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.081 -1.012 . . . . 0.0 110.247 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -50.27 160.63 0.36 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.17 -0.956 . . . . 0.0 110.258 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -132.11 150.07 52.24 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.297 -0.877 . . . . 0.0 110.299 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.33 27.29 1.97 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.27 -0.894 . . . . 0.0 110.313 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 50.94 63.12 2.37 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.223 -0.923 . . . . 0.0 110.184 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.457 ' O ' ' HB2' ' A' ' 142' ' ' GLU . 4.5 mtt85 -68.97 -41.35 78.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.269 -0.894 . . . . 0.0 110.247 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 141' ' ' ARG . 0.0 OUTLIER 60.3 -170.08 0.15 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.211 -0.931 . . . . 0.0 110.235 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 61.68 157.37 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.29 -0.881 . . . . 0.0 110.203 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.201 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.334 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -115.95 178.52 4.28 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.291 -1.123 . . . . 0.0 110.244 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 2.6 t 179.31 159.21 0.66 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.304 -0.872 . . . . 0.0 110.218 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 51.48 48.2 23.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.266 -0.896 . . . . 0.0 110.242 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.79 -11.1 12.93 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.234 -0.916 . . . . 0.0 110.187 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 50.63 -174.45 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.288 -0.883 . . . . 0.0 110.161 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.1 m -153.19 49.45 0.71 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.237 -0.914 . . . . 0.0 110.227 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.7 t -103.81 -18.16 14.77 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.275 -0.891 . . . . 0.0 110.181 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 95.2 p -160.22 146.61 15.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.93 . . . . 0.0 110.131 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -173.3 74.0 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.244 -0.91 . . . . 0.0 110.256 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.0 ttt180 -141.52 76.47 1.55 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.262 -0.899 . . . . 0.0 110.2 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.8 -35.9 9.28 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.235 -0.916 . . . . 0.0 110.385 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -61.18 -167.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.131 -0.981 . . . . 0.0 110.194 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -125.59 -146.36 0.34 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.211 -0.931 . . . . 0.0 110.19 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.433 ' O ' ' C ' ' A' ' 12' ' ' ASN . 1.7 mttt -49.93 -91.96 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.231 -0.918 . . . . 0.0 110.214 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.433 ' C ' ' O ' ' A' ' 11' ' ' LYS . 7.3 t30 42.47 77.74 0.06 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.208 -0.933 . . . . 0.0 110.231 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.697 HG22 HG22 ' A' ' 14' ' ' VAL . 3.2 mt -76.21 -71.22 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.322 -0.861 . . . . 0.0 110.284 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.697 HG22 HG22 ' A' ' 13' ' ' ILE . 2.7 m -143.06 144.25 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.252 -0.905 . . . . 0.0 110.31 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -116.95 41.06 2.83 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.248 -0.908 . . . . 0.0 110.048 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.86 174.72 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.274 -0.891 . . . . 0.0 110.225 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.41 ' O ' ' CB ' ' A' ' 18' ' ' SER . 16.5 m-85 -78.44 167.35 21.44 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.304 -0.873 . . . . 0.0 110.215 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.41 ' CB ' ' O ' ' A' ' 17' ' ' TYR . 0.4 OUTLIER 174.14 45.8 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 110.031 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -87.98 4.15 46.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.394 -0.816 . . . . 0.0 110.502 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.949 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -66.71 -48.59 68.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.096 -1.002 . . . . 0.0 110.236 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.452 ' HG3' HG13 ' A' ' 22' ' ' ILE . 24.4 pt-20 -43.55 -34.71 1.46 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.105 -0.997 . . . . 0.0 110.153 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.452 HG13 ' HG3' ' A' ' 21' ' ' GLU . 67.4 mt -74.53 -41.19 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.27 -0.894 . . . . 0.0 110.108 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -59.79 -46.5 88.99 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.225 -0.922 . . . . 0.0 110.193 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.919 HG22 HD21 ' A' ' 80' ' ' LEU . 16.8 t -60.27 -35.92 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.232 -0.917 . . . . 0.0 110.1 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -35.69 80.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.232 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -77.17 -34.8 56.33 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.238 -0.914 . . . . 0.0 110.085 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.7 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -63.66 -24.13 67.66 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.29 -0.881 . . . . 0.0 110.119 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.518 HG22 ' O ' ' A' ' 76' ' ' LYS . 56.2 p -115.45 55.16 0.78 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.222 -0.923 . . . . 0.0 110.088 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.8 t -67.92 -63.76 1.0 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.322 -0.861 . . . . 0.0 110.295 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -140.38 -61.23 0.51 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.215 -0.928 . . . . 0.0 110.348 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -142.75 152.83 60.36 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.211 -0.931 . . . . 0.0 110.23 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.447 ' O ' ' CB ' ' A' ' 33' ' ' TRP . 19.5 Cg_endo -65.29 -178.57 0.87 Allowed 'Trans proline' 0 C--N 1.307 -1.658 0 O-C-N 123.983 1.517 . . . . 0.0 110.555 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.447 ' CB ' ' O ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER 67.47 175.28 0.26 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.28 -0.887 . . . . 0.0 110.366 -179.919 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 121.67 -158.02 16.43 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.68 145.56 87.03 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.044 1.549 . . . . 0.0 110.51 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.22 122.86 16.66 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.281 -0.887 . . . . 0.0 110.216 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.3 m -127.82 169.04 14.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.308 -0.87 . . . . 0.0 110.064 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -120.12 50.16 1.33 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.192 -0.942 . . . . 0.0 110.43 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.7 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -110.32 -30.12 7.84 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.12 -0.987 . . . . 0.0 110.255 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 16.6 mtt -62.23 -62.16 1.96 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.271 -0.893 . . . . 0.0 110.242 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.439 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 50.0 m -53.97 -18.53 3.59 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.317 -0.865 . . . . 0.0 110.322 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -57.75 3.59 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.292 -0.88 . . . . 0.0 110.423 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.873 HG21 HD11 ' A' ' 80' ' ' LEU . 4.1 mt -48.34 -30.68 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.144 -0.973 . . . . 0.0 110.143 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.524 ' HA ' HD22 ' A' ' 84' ' ' LEU . . . -71.28 -56.04 6.82 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.095 -1.003 . . . . 0.0 109.558 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.462 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 12.1 t0 -49.98 -24.37 2.55 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.944 -1.098 . . . . 0.0 108.83 179.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.949 HD22 ' HB2' ' A' ' 20' ' ' ALA . 2.5 mt -74.04 -43.01 59.4 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.623 -0.673 . . . . 0.0 109.965 179.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.548 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 70.7 p -48.49 -42.97 34.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.163 -0.961 . . . . 0.0 109.324 179.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.568 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 79.8 m-85 -46.2 -47.48 17.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.261 -0.9 . . . . 0.0 109.237 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.549 ' O ' ' C ' ' A' ' 50' ' ' VAL . 1.1 t30 -68.74 91.34 0.44 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.549 -0.72 . . . . 0.0 110.434 179.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.549 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.65 -59.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.159 177.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.533 ' H ' HG13 ' A' ' 50' ' ' VAL . 2.6 t -62.65 -64.39 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.033 -1.042 . . . . 0.0 110.076 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.817 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -36.18 -48.09 0.6 Allowed 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.891 -177.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.548 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 13.9 t80 -57.67 -54.17 49.87 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.278 -0.889 . . . . 0.0 110.069 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.8 t -54.5 -24.6 21.2 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.298 -0.876 . . . . 0.0 110.042 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 51' ' ' VAL . 14.4 mm-40 -86.14 -28.02 24.24 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.283 -0.886 . . . . 0.0 109.973 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.858 HD11 ' HB3' ' A' ' 46' ' ' LEU . 6.4 mt -80.67 -70.31 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.345 -0.847 . . . . 0.0 110.147 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.445 ' HG2' ' HG2' ' A' ' 95' ' ' GLN . 0.9 OUTLIER -46.22 -39.42 9.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.322 -0.861 . . . . 0.0 110.031 179.766 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.4 m -56.44 -58.83 6.34 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.288 -0.882 . . . . 0.0 110.062 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 18.9 mmt -63.01 -15.93 58.08 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.253 -0.905 . . . . 0.0 109.968 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.787 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -81.31 -31.4 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 109.653 179.751 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.597 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 11.1 m95 -75.07 -46.13 36.84 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.287 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.47 ' HA ' ' OD1' ' A' ' 65' ' ' ASN . 11.4 mtpt -59.56 -53.18 61.01 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.278 -0.889 . . . . 0.0 109.981 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 85.8 mmt-85 -65.81 -9.63 30.36 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -0.884 . . . . 0.0 109.954 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.799 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 7.0 mt -88.53 -20.63 24.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.35 -0.844 . . . . 0.0 110.44 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.505 ' ND2' ' O ' ' A' ' 65' ' ' ASN . 2.4 p-10 -107.08 38.3 2.15 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.202 -0.936 . . . . 0.0 110.351 -179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.674 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.6 OUTLIER -55.45 -162.54 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.31 -0.869 . . . . 0.0 110.45 -179.789 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -122.31 -166.51 1.42 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.257 -0.902 . . . . 0.0 110.327 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -86.79 51.88 4.37 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -138.56 -36.73 0.56 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.402 -1.058 . . . . 0.0 110.106 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -144.0 54.2 1.3 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.413 -0.804 . . . . 0.0 110.136 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.422 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 65.6 p-90 -54.74 -17.55 3.6 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.288 -0.883 . . . . 0.0 110.171 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.36 -38.02 18.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.235 -0.916 . . . . 0.0 109.935 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.405 ' ND1' ' N ' ' A' ' 73' ' ' HIS . 2.5 m-70 -61.8 -41.33 97.61 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.353 -0.842 . . . . 0.0 109.861 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.674 HG23 ' HB2' ' A' ' 66' ' ' ASP . 28.7 t -58.08 -52.34 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.481 -0.762 . . . . 0.0 110.076 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.448 ' HB2' HG23 ' A' ' 123' ' ' VAL . 8.5 t80 -49.92 -53.18 27.68 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.335 -0.853 . . . . 0.0 110.15 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.518 ' O ' HG22 ' A' ' 28' ' ' THR . 4.9 mmtt -64.03 -25.55 68.17 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.246 -0.909 . . . . 0.0 110.107 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.799 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -73.38 -23.83 60.23 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.262 -0.899 . . . . 0.0 110.026 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.599 ' SD ' HD13 ' A' ' 106' ' ' LEU . 0.7 OUTLIER -77.12 -41.42 42.03 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.232 -0.917 . . . . 0.0 109.815 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.5 m -58.03 -55.7 31.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.463 -0.773 . . . . 0.0 110.062 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.919 HD21 HG22 ' A' ' 24' ' ' VAL . 31.8 tp -50.84 -57.63 7.98 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.367 -0.833 . . . . 0.0 109.784 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.597 ' HE1' ' CZ3' ' A' ' 61' ' ' TRP . 1.8 ttp -47.29 -32.57 4.8 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.244 -0.91 . . . . 0.0 110.225 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.419 ' O ' ' C ' ' A' ' 83' ' ' TYR . 0.8 OUTLIER -75.17 -68.21 0.58 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.192 -0.943 . . . . 0.0 110.589 -179.908 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.465 ' O ' HG22 ' A' ' 87' ' ' THR . 48.7 t80 -40.33 -37.25 0.64 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 111.027 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.544 ' C ' HG11 ' A' ' 92' ' ' VAL . 52.7 mt -76.09 -40.18 53.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.175 -0.953 . . . . 0.0 110.548 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.884 HG21 HD11 ' A' ' 134' ' ' LEU . 20.4 mt -53.47 -27.41 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 120.974 -1.079 . . . . 0.0 110.186 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.82 -74.78 0.49 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.121 -0.987 . . . . 0.0 110.422 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.496 HG23 ' HB1' ' A' ' 44' ' ' ALA . 11.2 t -86.06 -22.31 27.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.251 -0.905 . . . . 0.0 110.336 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.568 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -43.87 -74.06 0.22 Allowed Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 88' ' ' GLY . 3.1 t 172.25 160.75 0.11 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.151 -1.205 . . . . 0.0 110.293 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.07 -19.5 32.26 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.27 -0.894 . . . . 0.0 110.087 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 4.5 mtt-85 -76.52 -38.12 55.65 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.273 -0.892 . . . . 0.0 110.187 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.544 HG11 ' C ' ' A' ' 84' ' ' LEU . 71.6 t -60.01 -28.07 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.291 -0.881 . . . . 0.0 110.084 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 1.4 p -86.06 -38.54 17.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.234 -0.916 . . . . 0.0 110.162 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -58.84 -57.49 12.8 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.292 -0.88 . . . . 0.0 109.98 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.445 ' HG2' ' HG2' ' A' ' 57' ' ' MET . 0.2 OUTLIER -52.75 -35.74 56.72 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.4 -0.813 . . . . 0.0 109.875 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.495 ' O ' ' N ' ' A' ' 100' ' ' MET . 0.7 OUTLIER -59.55 -43.42 93.54 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.328 -0.858 . . . . 0.0 109.778 179.587 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -66.6 -35.93 81.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.322 179.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -80.84 -10.05 59.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.498 -0.752 . . . . 0.0 109.721 179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -135.64 26.87 3.38 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.43 -0.794 . . . . 0.0 109.848 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.495 ' N ' ' O ' ' A' ' 96' ' ' CYS . 0.2 OUTLIER -61.53 -29.83 70.25 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.354 -0.841 . . . . 0.0 109.917 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -57.82 -27.31 63.03 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.329 -0.857 . . . . 0.0 109.816 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.774 ' O ' HG22 ' A' ' 105' ' ' THR . . . -72.13 -41.52 67.07 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.41 -0.806 . . . . 0.0 110.043 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.463 ' CG1' HG23 ' A' ' 131' ' ' VAL . 3.3 t -76.9 -19.92 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.364 -0.835 . . . . 0.0 109.946 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.612 ' HG2' HG21 ' A' ' 131' ' ' VAL . 1.1 mt-30 -91.28 -23.75 20.06 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.276 -0.89 . . . . 0.0 110.124 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.774 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.7 t -75.85 -24.31 55.76 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.252 -0.905 . . . . 0.0 110.098 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.754 HD11 HD22 ' A' ' 64' ' ' LEU . 10.0 mt -61.05 -42.67 98.92 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.262 -0.899 . . . . 0.0 109.967 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.513 ' HA ' ' CA ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -59.74 -22.75 62.49 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.198 -0.939 . . . . 0.0 110.014 179.762 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -97.88 -17.97 18.97 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.304 -0.872 . . . . 0.0 110.189 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.488 ' C ' ' CD1' ' A' ' 109' ' ' PHE . 1.4 t80 -67.15 91.77 0.24 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.224 -0.922 . . . . 0.0 110.013 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.422 ' O ' ' HB2' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -97.94 135.8 39.14 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.34 -0.85 . . . . 0.0 110.255 -179.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.422 ' HB2' ' O ' ' A' ' 110' ' ' GLN . 0.3 OUTLIER -178.19 115.41 0.08 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.278 -0.889 . . . . 0.0 110.163 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.656 ' O ' HG12 ' A' ' 112' ' ' VAL . 98.1 t -109.96 57.82 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.271 -0.893 . . . . 0.0 110.182 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.9 t70 51.29 -138.79 1.02 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.19 -0.943 . . . . 0.0 110.101 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.506 ' CD ' ' N ' ' A' ' 114' ' ' ARG . 0.0 OUTLIER -89.58 -65.94 0.97 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.192 -0.943 . . . . 0.0 109.447 179.76 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -124.18 36.1 4.69 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.558 -0.714 . . . . 0.0 110.118 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.454 ' CA ' HG12 ' A' ' 112' ' ' VAL . . . -65.86 -153.59 0.19 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.47 ' O ' ' O ' ' A' ' 118' ' ' ASP . 2.1 ttpm? -155.95 87.12 1.06 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.291 -1.123 . . . . 0.0 110.296 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.47 ' O ' ' O ' ' A' ' 117' ' ' LYS . 1.7 t70 39.41 94.96 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.476 -0.765 . . . . 0.0 110.736 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.419 ' HG3' ' NE1' ' A' ' 71' ' ' TRP . 12.9 pt20 -143.34 10.91 1.7 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.151 -0.968 . . . . 0.0 110.442 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.453 ' O ' ' HB ' ' A' ' 123' ' ' VAL . . . -104.38 -3.95 43.94 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.594 HG12 ' N ' ' A' ' 122' ' ' ASN . 6.6 t -43.01 -73.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.279 -1.13 . . . . 0.0 111.031 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.594 ' N ' HG12 ' A' ' 121' ' ' VAL . 16.2 m-80 -33.63 -33.54 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.766 -0.583 . . . . 0.0 111.197 -178.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.599 HG22 HG12 ' A' ' 74' ' ' VAL . 1.7 t -77.58 -49.2 22.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.916 -1.115 . . . . 0.0 109.703 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.513 ' CA ' ' HA ' ' A' ' 107' ' ' LYS . 10.9 mtm-85 -60.79 -56.6 19.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.109 -0.995 . . . . 0.0 110.732 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -62.1 -51.11 69.22 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.271 -0.893 . . . . 0.0 110.956 -179.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 122' ' ' ASN . 0.6 OUTLIER -50.43 -48.32 56.31 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.012 -1.055 . . . . 0.0 110.255 -179.688 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -55.19 -46.04 75.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.36 -0.838 . . . . 0.0 110.591 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.7 tttt -62.12 -35.48 78.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.115 -0.991 . . . . 0.0 110.414 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -60.36 -51.48 69.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -0.913 . . . . 0.0 110.555 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.76 HD21 ' CD1' ' A' ' 85' ' ' ILE . 2.1 tt -53.9 -36.76 63.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.14 -0.975 . . . . 0.0 110.295 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.612 HG21 ' HG2' ' A' ' 104' ' ' GLN . 76.5 t -74.87 -27.1 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.353 -0.842 . . . . 0.0 110.144 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 136' ' ' ASP . . . -68.42 -51.5 43.16 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.374 -0.829 . . . . 0.0 110.576 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.58 HD11 HD12 ' A' ' 134' ' ' LEU . 2.2 pp -63.83 -26.04 68.44 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.202 -0.936 . . . . 0.0 110.384 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.884 HD11 HG21 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -87.62 -13.69 42.05 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.268 -0.895 . . . . 0.0 110.106 179.881 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -156.53 83.85 0.97 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.338 -0.851 . . . . 0.0 110.155 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.455 ' HB2' ' O ' ' A' ' 132' ' ' ALA . 6.6 t70 -122.02 -22.94 5.52 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.299 -0.875 . . . . 0.0 110.444 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -57.44 104.49 0.18 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.147 -0.97 . . . . 0.0 110.217 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -143.76 76.49 1.52 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.267 -0.896 . . . . 0.0 110.206 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -52.13 -60.84 2.73 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.271 -0.893 . . . . 0.0 110.249 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.1 mp -81.62 161.65 23.39 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.35 -0.844 . . . . 0.0 110.203 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -91.06 84.92 5.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.285 -0.884 . . . . 0.0 110.183 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' A' ' 144' ' ' ARG . 2.6 mp0 -86.36 -47.75 9.08 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.22 -0.925 . . . . 0.0 110.111 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 47.84 -91.12 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.335 -0.853 . . . . 0.0 110.182 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 142' ' ' GLU . 1.3 tpt180 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.211 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 109.466 -1.453 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 20.6 p -65.72 132.15 48.07 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.284 -1.127 . . . . 0.0 110.202 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 4.7 t 56.61 -153.8 0.35 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.239 -0.913 . . . . 0.0 110.227 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . 0.524 ' O ' ' N ' ' A' ' 2' ' ' SER . 20.3 mtm105 -136.53 -154.47 0.56 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.273 -0.892 . . . . 0.0 110.182 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mtp 48.54 -90.5 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.295 -0.878 . . . . 0.0 110.237 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.524 ' N ' ' O ' ' A' ' 0' ' ' ARG . 54.8 p -162.69 172.91 14.58 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 110.173 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 p -106.77 -6.82 17.52 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.248 -0.908 . . . . 0.0 110.146 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 t 59.25 -172.98 0.11 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.287 -0.883 . . . . 0.0 110.119 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.5 m -122.74 174.6 7.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.183 -0.948 . . . . 0.0 110.223 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.7 mp -122.48 146.48 47.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.231 -0.918 . . . . 0.0 110.193 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.22 17.86 1.08 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.215 -0.928 . . . . 0.0 110.146 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -64.77 156.18 31.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.31 -0.869 . . . . 0.0 110.26 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -101.45 150.47 23.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.284 -0.885 . . . . 0.0 110.243 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.4 mmt -104.92 -63.46 1.22 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.285 -0.885 . . . . 0.0 110.188 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -66.16 171.64 4.5 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.331 -0.855 . . . . 0.0 110.225 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.414 ' OD1' ' O ' ' A' ' 12' ' ' ASN . 7.3 p30 -100.1 113.32 25.86 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.303 -0.873 . . . . 0.0 110.151 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 tt -98.78 1.34 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.305 -0.872 . . . . 0.0 110.322 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 31.5 t -74.23 104.96 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.191 -0.943 . . . . 0.0 110.237 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -148.33 146.84 28.72 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 110.299 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 -143.45 79.07 1.62 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.279 -0.888 . . . . 0.0 110.115 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.438 ' CD2' ' OE2' ' A' ' 19' ' ' GLU . 38.5 p90 -95.59 149.76 21.09 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.213 -0.929 . . . . 0.0 110.302 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.466 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 0.5 OUTLIER -126.57 -30.8 2.79 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.299 -0.876 . . . . 0.0 110.126 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 18' ' ' SER . 28.1 mt-10 56.28 17.44 2.83 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.274 -0.891 . . . . 0.0 110.422 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.76 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -67.85 -50.14 58.26 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.184 -0.947 . . . . 0.0 110.141 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HG3' HG13 ' A' ' 22' ' ' ILE . 16.7 pt-20 -49.21 -29.68 5.97 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.22 -0.925 . . . . 0.0 110.205 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.465 HG13 ' HG3' ' A' ' 21' ' ' GLU . 55.8 mt -74.71 -39.89 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.206 -0.934 . . . . 0.0 110.011 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.675 ' O ' HD11 ' A' ' 43' ' ' ILE . 14.7 mttp -70.66 -23.99 62.61 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.383 -0.823 . . . . 0.0 110.073 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.744 HG21 ' HA ' ' A' ' 56' ' ' ILE . 72.3 t -79.55 -34.1 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.249 -0.907 . . . . 0.0 110.152 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -40.38 87.73 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.296 -0.877 . . . . 0.0 110.263 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -44.12 54.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.335 -0.853 . . . . 0.0 110.176 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.631 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -57.06 -20.55 25.59 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.242 -0.911 . . . . 0.0 110.114 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.546 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 2.5 p -93.1 -83.63 0.31 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.214 -0.929 . . . . 0.0 110.077 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.0 t -69.59 98.67 1.18 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.165 -0.959 . . . . 0.0 110.196 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -106.8 29.19 7.23 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.316 -0.865 . . . . 0.0 110.235 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.582 ' N ' ' CD ' ' A' ' 32' ' ' PRO . 0.4 OUTLIER -54.14 -48.12 95.21 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.28 -0.888 . . . . 0.0 110.157 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.582 ' CD ' ' N ' ' A' ' 31' ' ' ASP . 37.1 Cg_exo -56.27 174.69 0.32 Allowed 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.018 1.536 . . . . 0.0 110.334 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -102.11 -177.47 3.42 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.265 -0.897 . . . . 0.0 110.519 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 136.09 149.27 5.7 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.704 -1.358 . . . . 0.0 109.704 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -67.6 177.54 3.97 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 O-C-N 124.056 1.556 . . . . 0.0 110.526 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.7 m -132.1 152.06 51.43 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.329 -0.857 . . . . 0.0 109.99 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 38' ' ' SER . 0.4 OUTLIER -143.23 -59.2 0.42 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.231 -0.918 . . . . 0.0 110.355 -179.875 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.418 ' HB2' ' O ' ' A' ' 37' ' ' SER . 5.0 t 176.21 53.25 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.203 -0.935 . . . . 0.0 110.121 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.631 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 13.1 tp -65.07 -35.18 80.33 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.248 -0.908 . . . . 0.0 110.333 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.09 -42.61 99.65 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.15 -0.969 . . . . 0.0 110.316 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.422 ' HA ' ' OH ' ' A' ' 83' ' ' TYR . 0.3 OUTLIER -61.53 -33.46 73.86 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.118 -0.989 . . . . 0.0 110.193 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.08 -44.23 60.79 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.195 -0.94 . . . . 0.0 110.0 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.726 HG21 HD11 ' A' ' 80' ' ' LEU . 85.4 mt -59.64 -31.34 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.192 -0.942 . . . . 0.0 110.021 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.731 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -72.58 -52.79 14.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.924 . . . . 0.0 109.522 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.465 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 27.9 t0 -51.52 -22.39 3.14 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.988 -1.07 . . . . 0.0 108.679 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.76 HD13 ' CB ' ' A' ' 20' ' ' ALA . 15.1 mt -77.68 -40.64 40.8 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.593 -0.692 . . . . 0.0 109.908 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.52 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 68.0 p -49.64 -42.95 46.4 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.154 -0.967 . . . . 0.0 109.407 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.545 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 85.3 m-85 -44.88 -45.37 10.25 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.241 -0.912 . . . . 0.0 109.486 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.534 ' O ' ' N ' ' A' ' 51' ' ' VAL . 3.4 t-20 -71.47 92.65 1.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.511 -0.743 . . . . 0.0 110.331 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.523 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.75 -56.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.863 178.301 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.54 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.8 t -64.21 -65.7 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 120.954 -1.091 . . . . 0.0 110.495 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.684 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.51 -45.01 0.7 Allowed 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 121.169 0.509 . . . . 0.0 110.972 -177.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.585 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 16.7 t80 -60.19 -53.82 53.14 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.32 -0.862 . . . . 0.0 110.425 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' A' ' 58' ' ' SER . 9.2 t -56.62 -21.07 24.46 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.221 -0.924 . . . . 0.0 110.152 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -93.75 -22.46 18.69 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -0.894 . . . . 0.0 110.368 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.744 ' HA ' HG21 ' A' ' 24' ' ' VAL . 30.1 mt -81.67 -55.95 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.242 -0.911 . . . . 0.0 110.203 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.602 ' HE2' ' HG2' ' A' ' 95' ' ' GLN . 90.8 mmm -58.6 -36.12 73.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.196 -0.94 . . . . 0.0 109.705 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' ' 54' ' ' SER . 0.3 OUTLIER -59.02 -55.3 36.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.332 -0.855 . . . . 0.0 109.801 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.554 ' HB2' HG11 ' A' ' 24' ' ' VAL . 3.0 mmt -63.29 -25.08 68.15 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.225 -0.922 . . . . 0.0 109.766 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.685 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -73.67 -31.0 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.519 -0.738 . . . . 0.0 109.824 179.817 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.468 ' CZ2' ' HE1' ' A' ' 81' ' ' MET . 16.4 m95 -76.39 -56.99 4.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.127 -0.983 . . . . 0.0 110.143 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -45.13 -50.84 10.97 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.247 -0.908 . . . . 0.0 110.214 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -68.38 -31.87 71.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.212 -0.93 . . . . 0.0 110.151 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.793 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 7.4 mt -65.25 -26.82 68.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.29 -0.882 . . . . 0.0 110.054 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -101.15 36.52 1.97 Allowed 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.338 -0.851 . . . . 0.0 109.933 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.472 ' O ' ' HB3' ' A' ' 67' ' ' HIS . 2.0 t70 -66.82 177.95 1.5 Allowed 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.46 -0.775 . . . . 0.0 110.094 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.472 ' HB3' ' O ' ' A' ' 66' ' ' ASP . 24.7 p80 178.79 178.54 0.43 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.501 -0.75 . . . . 0.0 110.179 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.413 ' O ' ' C ' ' A' ' 69' ' ' LYS . . . 59.55 -88.15 0.02 OUTLIER Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.847 -1.301 . . . . 0.0 109.847 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.413 ' C ' ' O ' ' A' ' 68' ' ' GLY . 8.9 mmtt -43.68 -87.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.122 -1.223 . . . . 0.0 110.186 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -159.24 149.49 19.22 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.394 -0.816 . . . . 0.0 110.325 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.408 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 51.2 p-90 -80.37 7.1 10.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.264 -0.898 . . . . 0.0 110.118 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.54 -37.74 58.29 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.264 -0.897 . . . . 0.0 110.215 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -68.04 -32.03 72.11 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.303 -0.873 . . . . 0.0 110.204 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.677 HG12 ' HE2' ' A' ' 78' ' ' MET . 27.1 t -64.71 -59.4 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.196 -0.94 . . . . 0.0 110.2 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -47.02 -53.42 12.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.266 -0.896 . . . . 0.0 109.936 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.546 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -59.27 -33.07 70.61 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.239 -0.913 . . . . 0.0 109.63 179.59 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.793 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -66.71 -28.85 68.76 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.287 -0.883 . . . . 0.0 109.645 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.677 ' HE2' HG12 ' A' ' 74' ' ' VAL . 1.8 mtt -71.0 -32.92 69.86 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.282 -0.886 . . . . 0.0 109.923 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.0 m -67.87 -37.1 81.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.326 -0.859 . . . . 0.0 110.307 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.726 HD11 HG21 ' A' ' 43' ' ' ILE . 23.1 tp -73.06 -37.85 66.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.213 -0.929 . . . . 0.0 110.022 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.613 ' HG2' HD21 ' A' ' 130' ' ' LEU . 3.2 ttt -73.61 -27.0 61.06 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.173 -0.955 . . . . 0.0 109.946 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.5 ' HG3' HD12 ' A' ' 130' ' ' LEU . 1.8 tt0 -80.05 -37.67 33.5 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 110.015 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.422 ' OH ' ' HA ' ' A' ' 41' ' ' SER . 37.1 t80 -72.7 -46.06 55.64 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.386 -0.821 . . . . 0.0 110.349 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.731 HD23 ' HB2' ' A' ' 44' ' ' ALA . 76.3 mt -66.63 -43.54 84.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.266 -0.896 . . . . 0.0 110.34 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.66 HD13 HD11 ' A' ' 134' ' ' LEU . 8.6 mt -53.41 -19.32 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.107 -0.996 . . . . 0.0 109.681 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -96.22 -79.32 0.45 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.272 -0.893 . . . . 0.0 110.18 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 88' ' ' GLY . 10.2 t -80.08 -23.63 41.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.221 -0.924 . . . . 0.0 110.288 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.56 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -43.97 -71.11 0.48 Allowed Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.466 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.6 OUTLIER 171.78 160.59 0.1 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.203 -1.175 . . . . 0.0 110.174 179.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -59.61 -16.17 23.92 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.219 -0.925 . . . . 0.0 110.093 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.0 mmt180 -79.79 -40.97 27.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.281 -0.887 . . . . 0.0 110.323 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.458 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 53.1 t -57.91 -38.17 64.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.151 -0.968 . . . . 0.0 109.933 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.2 m -71.49 -42.69 67.73 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.177 -0.952 . . . . 0.0 109.779 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -56.13 -39.73 72.7 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.287 -0.883 . . . . 0.0 109.777 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.602 ' HG2' ' HE2' ' A' ' 57' ' ' MET . 3.9 tt0 -68.64 -38.02 80.17 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.376 -0.827 . . . . 0.0 109.296 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.681 ' SG ' HD22 ' A' ' 134' ' ' LEU . 51.8 t -58.1 -28.62 64.78 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.028 -1.045 . . . . 0.0 108.807 178.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -87.2 -20.99 26.15 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.519 -0.738 . . . . 0.0 110.04 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 3.1 pt-20 -84.52 -20.01 32.3 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.104 -0.998 . . . . 0.0 109.932 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -124.7 44.49 2.76 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.394 -0.816 . . . . 0.0 110.099 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.12 -34.73 76.9 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.247 -0.908 . . . . 0.0 110.106 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -59.94 -21.44 61.17 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.362 -0.836 . . . . 0.0 110.01 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.756 ' O ' HG22 ' A' ' 105' ' ' THR . . . -82.46 -42.39 18.57 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.327 -0.858 . . . . 0.0 110.292 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.555 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.6 t -75.06 -18.82 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.325 -0.859 . . . . 0.0 110.268 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.501 ' HG2' HG21 ' A' ' 131' ' ' VAL . 6.8 mm-40 -95.33 -27.77 15.3 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.212 -0.93 . . . . 0.0 110.649 -179.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.756 HG22 ' O ' ' A' ' 102' ' ' ALA . 9.7 t -64.95 -14.67 60.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.089 -1.007 . . . . 0.0 110.094 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.723 HD11 HD22 ' A' ' 64' ' ' LEU . 8.9 mt -65.26 -34.23 77.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.356 -0.84 . . . . 0.0 110.197 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -13.4 51.71 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.343 -0.848 . . . . 0.0 110.428 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.444 ' O ' ' C ' ' A' ' 109' ' ' PHE . 2.1 t0 -90.36 -11.15 41.45 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.205 -0.934 . . . . 0.0 110.453 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.463 ' HB2' ' O ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -37.78 144.73 0.08 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.518 -0.739 . . . . 0.0 110.746 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -138.44 123.27 18.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.237 -0.914 . . . . 0.0 110.045 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -175.67 135.02 0.3 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.215 -0.928 . . . . 0.0 110.211 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.54 ' O ' HG12 ' A' ' 112' ' ' VAL . 37.1 t -131.99 0.41 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.295 -0.878 . . . . 0.0 110.179 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.2 t0 49.41 -146.19 0.38 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.27 -0.894 . . . . 0.0 110.119 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.569 ' CG ' ' N ' ' A' ' 115' ' ' ASP . 9.8 ptt180 -97.59 -45.97 6.2 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.257 -0.902 . . . . 0.0 109.95 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.569 ' N ' ' CG ' ' A' ' 114' ' ' ARG . 12.1 t70 -40.24 -27.95 0.05 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.593 -0.692 . . . . 0.0 110.36 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.506 ' HA2' ' CG1' ' A' ' 112' ' ' VAL . . . 88.4 -179.5 46.39 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.6 tttp 62.91 139.49 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.274 -1.133 . . . . 0.0 110.305 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -72.51 137.98 46.67 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.328 -0.857 . . . . 0.0 110.161 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -132.24 33.68 3.84 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.203 -0.936 . . . . 0.0 110.18 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -115.49 25.65 9.59 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.546 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p -78.06 -44.0 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.154 -1.204 . . . . 0.0 110.042 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.546 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.6 OUTLIER -49.08 -50.96 34.32 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.488 -0.758 . . . . 0.0 110.007 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.598 ' CG2' ' CG1' ' A' ' 74' ' ' VAL . 6.4 p -74.24 -20.61 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.072 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.457 ' HB3' ' O ' ' A' ' 121' ' ' VAL . 9.9 ttt180 -68.29 -65.29 0.72 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.153 -0.967 . . . . 0.0 110.392 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -62.07 -28.92 69.95 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.382 -0.824 . . . . 0.0 110.47 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -58.55 7.95 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.063 -1.023 . . . . 0.0 110.082 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -51.87 -40.27 60.35 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.202 -0.936 . . . . 0.0 110.0 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -63.36 -36.85 85.09 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.282 -0.886 . . . . 0.0 110.375 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.49 -49.81 73.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.253 -0.904 . . . . 0.0 110.404 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.613 HD21 ' HG2' ' A' ' 81' ' ' MET . 0.9 OUTLIER -56.98 -28.84 62.73 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.963 -1.086 . . . . 0.0 109.654 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.501 HG21 ' HG2' ' A' ' 104' ' ' GLN . 55.7 t -78.53 -27.78 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.282 -0.886 . . . . 0.0 109.728 179.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -75.61 -57.41 3.9 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.378 -0.826 . . . . 0.0 110.374 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.95 -34.85 4.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.218 -0.926 . . . . 0.0 110.446 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.681 HD22 ' SG ' ' A' ' 96' ' ' CYS . 0.4 OUTLIER -83.06 -33.65 26.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.134 -0.979 . . . . 0.0 110.394 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -119.28 102.66 8.86 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.165 -0.959 . . . . 0.0 110.189 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -151.98 -78.15 0.12 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.2 -0.938 . . . . 0.0 110.269 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -157.49 147.36 20.46 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.25 -0.906 . . . . 0.0 110.303 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -60.98 87.87 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.337 -0.852 . . . . 0.0 110.354 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.71 93.04 8.7 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.295 -0.878 . . . . 0.0 110.253 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.8 mt -112.7 -82.92 0.59 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.179 -0.951 . . . . 0.0 110.178 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.63 149.06 42.03 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.256 -0.902 . . . . 0.0 110.17 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -145.36 64.77 1.25 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.272 -0.893 . . . . 0.0 110.119 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -92.64 -84.68 0.28 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.334 -0.853 . . . . 0.0 110.294 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 6.8 ttt-85 . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.257 -179.874 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 50.3 m -152.72 147.84 26.56 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.161 -1.2 . . . . 0.0 110.346 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 1.8 m -143.8 -55.19 0.37 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.377 -0.827 . . . . 0.0 110.137 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.5 -78.93 0.48 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.207 -0.933 . . . . 0.0 110.234 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 ptp -114.49 169.3 9.15 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.281 -0.887 . . . . 0.0 110.141 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -179.11 -171.8 0.22 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.285 -0.884 . . . . 0.0 110.32 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 99.3 m -50.69 104.4 0.07 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.322 -0.861 . . . . 0.0 110.21 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.3 p -156.5 102.4 2.07 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.247 -0.908 . . . . 0.0 110.165 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.5 p -105.21 176.92 5.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.224 -0.922 . . . . 0.0 110.262 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.0 mt -94.34 145.25 24.89 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.231 -0.918 . . . . 0.0 110.255 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -92.32 85.17 5.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.28 -0.888 . . . . 0.0 110.2 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.87 -24.9 8.43 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.276 -0.89 . . . . 0.0 110.219 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -91.89 105.19 17.51 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.255 -0.903 . . . . 0.0 110.188 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 29.8 mtp -106.38 -151.54 0.46 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.306 -0.871 . . . . 0.0 110.142 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.2 ptmt -52.09 154.46 2.27 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.264 -0.897 . . . . 0.0 110.269 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -115.43 -178.2 3.32 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.276 -0.89 . . . . 0.0 110.182 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 98.1 mt -61.14 121.49 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.308 -0.87 . . . . 0.0 110.269 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.447 ' O ' ' C ' ' A' ' 15' ' ' HIS . 2.9 m -123.52 144.86 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.292 -0.88 . . . . 0.0 110.196 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.447 ' C ' ' O ' ' A' ' 14' ' ' VAL . 5.1 t60 38.49 63.92 0.81 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.494 -0.754 . . . . 0.0 110.633 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -53.1 162.74 0.62 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.218 -0.926 . . . . 0.0 110.219 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -104.44 172.07 6.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.217 -0.927 . . . . 0.0 110.09 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 61.41 68.03 0.74 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.25 -0.906 . . . . 0.0 110.144 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -124.65 -3.65 7.77 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.27 -0.894 . . . . 0.0 110.29 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.617 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -58.42 -50.34 74.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.152 -0.968 . . . . 0.0 110.133 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' A' ' 20' ' ' ALA . 8.0 pt-20 -43.23 -29.64 0.41 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.27 -0.893 . . . . 0.0 110.08 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.7 mt -82.59 -43.13 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.238 -0.914 . . . . 0.0 110.073 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.624 ' O ' HD11 ' A' ' 43' ' ' ILE . 8.0 mmtm -57.11 -32.34 66.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.311 -0.868 . . . . 0.0 110.111 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.965 HG13 ' CD2' ' A' ' 80' ' ' LEU . 87.0 t -76.34 -43.6 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.986 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.18 -39.22 74.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.316 -0.865 . . . . 0.0 110.126 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -83.18 -29.48 28.53 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.393 -0.817 . . . . 0.0 110.154 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.893 ' HB2' HD12 ' A' ' 39' ' ' LEU . . . -62.14 -25.05 67.52 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.299 -0.876 . . . . 0.0 110.014 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.501 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 28.3 p -100.84 33.77 2.69 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.259 -0.901 . . . . 0.0 110.111 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 34.0 t -167.58 105.87 0.53 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 0.0 110.183 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -174.15 167.98 4.1 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.249 -0.907 . . . . 0.0 110.204 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.429 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 2.5 p30 -86.87 147.95 44.46 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.313 -0.867 . . . . 0.0 110.176 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.45 ' O ' ' CB ' ' A' ' 33' ' ' TRP . 35.2 Cg_exo -56.09 -174.99 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 123.982 1.517 . . . . 0.0 110.275 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.45 ' CB ' ' O ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER 66.09 174.54 0.23 Allowed 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.212 -0.93 . . . . 0.0 110.497 -179.879 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 113.92 95.94 2.15 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -62.57 -34.34 75.3 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 124.006 1.529 . . . . 0.0 110.262 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.4 p -114.6 146.98 40.16 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 110.057 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.412 ' O ' ' OG ' ' A' ' 37' ' ' SER . 1.4 p -152.71 113.07 4.04 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.264 -0.898 . . . . 0.0 110.268 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.08 61.48 0.61 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.276 -0.89 . . . . 0.0 110.047 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.893 HD12 ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -131.46 -39.71 1.13 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.217 -0.927 . . . . 0.0 110.318 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 8.2 mmm -75.84 -60.67 2.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.235 -0.916 . . . . 0.0 110.464 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 86.0 p -48.93 -29.33 4.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.167 -0.958 . . . . 0.0 110.366 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -74.36 -53.5 9.51 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.264 -0.897 . . . . 0.0 110.403 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.843 HG21 HD11 ' A' ' 80' ' ' LEU . 44.4 mt -53.52 -39.62 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -0.925 . . . . 0.0 110.112 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.702 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -66.36 -51.08 60.78 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.076 -1.015 . . . . 0.0 109.168 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.48 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -56.22 -19.33 13.37 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.088 -1.008 . . . . 0.0 108.862 178.874 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.705 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 13.5 mt -82.76 -38.53 23.08 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.572 -0.705 . . . . 0.0 110.092 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.591 HG21 HG21 ' A' ' 92' ' ' VAL . 61.7 p -51.75 -43.28 62.86 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.078 -1.014 . . . . 0.0 109.223 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.48 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 88.3 m-85 -43.18 -43.41 4.64 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.475 -0.765 . . . . 0.0 109.485 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.543 ' O ' ' N ' ' A' ' 51' ' ' VAL . 2.6 t-20 -73.17 93.44 1.84 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.558 -0.714 . . . . 0.0 110.328 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.519 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -9.95 -56.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.908 178.37 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.543 ' N ' ' O ' ' A' ' 49' ' ' ASN . 3.1 t -66.19 -66.29 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.044 -1.035 . . . . 0.0 110.701 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.705 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.64 -46.09 0.84 Allowed 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 120.49 -0.484 . . . . 0.0 111.022 -177.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.532 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 3.1 t80 -56.44 -53.91 51.87 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.29 -0.881 . . . . 0.0 110.037 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.2 m -57.18 -21.83 36.09 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.144 -0.973 . . . . 0.0 110.025 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -88.95 -24.64 22.38 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.357 -0.839 . . . . 0.0 110.189 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.758 HG12 HG23 ' A' ' 43' ' ' ILE . 4.1 mt -79.15 -70.32 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.405 -0.809 . . . . 0.0 110.229 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.456 ' N ' HG22 ' A' ' 56' ' ' ILE . 5.0 mtp -46.17 -38.33 8.15 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.221 -0.925 . . . . 0.0 109.772 179.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -54.69 -62.08 1.89 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.358 -0.838 . . . . 0.0 110.048 179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -23.11 58.86 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.969 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.769 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.3 OUTLIER -73.95 -31.75 31.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.295 -0.878 . . . . 0.0 109.834 179.718 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.79 ' CZ2' ' HE1' ' A' ' 81' ' ' MET . 14.0 m95 -76.29 -63.44 1.33 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.138 -0.976 . . . . 0.0 110.265 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -44.83 -45.43 10.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.297 -0.877 . . . . 0.0 110.405 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -69.69 -34.15 73.52 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.286 -0.884 . . . . 0.0 110.386 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.979 HD22 HD11 ' A' ' 106' ' ' LEU . 7.5 mt -57.51 -20.52 31.99 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.221 -0.925 . . . . 0.0 110.42 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.457 ' O ' ' O ' ' A' ' 66' ' ' ASP . 3.4 m120 -107.44 39.88 1.81 Allowed 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.252 -0.905 . . . . 0.0 110.136 -179.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.483 ' OD2' ' HB2' ' A' ' 73' ' ' HIS . 1.7 t0 -55.05 -163.16 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.302 -0.874 . . . . 0.0 110.356 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.47 -176.08 5.94 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.347 -0.846 . . . . 0.0 110.257 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.492 ' HA3' ' CD2' ' A' ' 111' ' ' TYR . . . -72.75 -56.73 5.77 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -70.33 -23.4 62.82 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.254 -1.145 . . . . 0.0 110.312 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.458 ' O ' ' OD2' ' A' ' 66' ' ' ASP . 40.0 m-20 -96.38 47.57 1.08 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.317 -0.864 . . . . 0.0 110.501 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.523 ' CE2' ' CD ' ' A' ' 119' ' ' GLN . 47.7 p-90 -77.3 -11.02 59.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.228 -0.92 . . . . 0.0 110.228 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.76 -28.52 22.68 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.262 -0.899 . . . . 0.0 110.018 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.483 ' HB2' ' OD2' ' A' ' 66' ' ' ASP . 0.3 OUTLIER -78.1 -35.12 49.65 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.269 -0.894 . . . . 0.0 110.021 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.776 HG22 ' O ' ' A' ' 64' ' ' LEU . 13.3 t -60.65 -55.31 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.338 -0.851 . . . . 0.0 109.758 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -52.48 -52.85 52.26 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.35 -0.844 . . . . 0.0 109.874 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.501 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -61.13 -24.84 66.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.314 -0.866 . . . . 0.0 109.991 179.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.765 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -74.64 -34.02 62.67 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.309 -0.869 . . . . 0.0 109.997 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.624 ' SD ' ' HB2' ' A' ' 127' ' ' ALA . 0.0 OUTLIER -66.87 -30.87 71.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.371 -0.831 . . . . 0.0 109.462 179.513 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.2 m -66.73 -64.05 0.94 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.499 -0.75 . . . . 0.0 109.946 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.965 ' CD2' HG13 ' A' ' 24' ' ' VAL . 29.9 tp -46.87 -46.81 21.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.322 -0.861 . . . . 0.0 110.135 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 1.012 ' HG2' HD21 ' A' ' 130' ' ' LEU . 19.6 ttm -56.53 -42.99 79.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.114 -0.991 . . . . 0.0 110.205 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.718 ' HA ' HD12 ' A' ' 85' ' ' ILE . 62.6 tt0 -68.49 -65.91 0.64 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.243 -0.91 . . . . 0.0 110.336 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.582 ' O ' HG22 ' A' ' 87' ' ' THR . 57.9 t80 -37.52 -47.78 0.94 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.454 -0.779 . . . . 0.0 110.791 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.702 HD23 ' HB2' ' A' ' 44' ' ' ALA . 68.4 mt -68.03 -43.93 77.64 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.842 . . . . 0.0 110.222 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.001 HD13 HD11 ' A' ' 134' ' ' LEU . 23.5 mt -47.9 -29.54 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.033 -1.042 . . . . 0.0 109.75 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.63 -72.6 0.61 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.326 -0.859 . . . . 0.0 110.111 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.582 HG22 ' O ' ' A' ' 83' ' ' TYR . 8.0 t -83.8 -27.44 28.8 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.278 -0.889 . . . . 0.0 110.108 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.558 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -44.16 -85.83 0.01 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.466 ' O ' ' HB ' ' A' ' 92' ' ' VAL . 1.3 t -175.78 154.44 1.54 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -1.184 . . . . 0.0 110.382 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -47.68 -44.98 27.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.247 -0.908 . . . . 0.0 110.615 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -59.47 -43.43 93.24 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.42 -0.8 . . . . 0.0 110.199 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.625 HG11 ' CB ' ' A' ' 84' ' ' LEU . 18.9 t -53.12 -25.55 9.9 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.483 0 O-C-N 121.318 -0.864 . . . . 0.0 109.85 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.0 t -91.2 -35.13 14.7 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 110.059 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -61.61 -53.01 61.91 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.294 -0.878 . . . . 0.0 110.018 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 11.2 tt0 -60.22 -38.52 83.63 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.332 -0.855 . . . . 0.0 109.254 179.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.651 ' SG ' HD11 ' A' ' 85' ' ' ILE . 0.1 OUTLIER -55.77 -30.19 60.88 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.104 -0.998 . . . . 0.0 109.016 179.144 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.53 -23.55 27.66 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.447 -0.783 . . . . 0.0 110.254 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 95' ' ' GLN . 4.8 pt-20 -80.42 -21.5 42.14 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.189 -0.944 . . . . 0.0 109.635 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.54 41.13 2.9 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.494 -0.754 . . . . 0.0 109.836 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.431 ' HG3' ' N ' ' A' ' 101' ' ' TYR . 0.4 OUTLIER -61.04 -24.85 66.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.353 -0.842 . . . . 0.0 110.255 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.471 ' O ' ' HB ' ' A' ' 105' ' ' THR . 20.6 m-85 -68.67 -27.87 66.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.0 109.673 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 1.011 ' O ' HG22 ' A' ' 105' ' ' THR . . . -75.64 -43.62 46.85 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.439 -0.788 . . . . 0.0 110.062 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.607 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 2.9 t -71.36 -29.03 33.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.413 -0.804 . . . . 0.0 110.042 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.48 ' HG2' HG21 ' A' ' 131' ' ' VAL . 0.3 OUTLIER -83.56 -28.59 28.47 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.215 -0.928 . . . . 0.0 110.362 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 1.011 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.1 t -60.84 -23.51 65.16 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.193 -0.942 . . . . 0.0 110.108 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.979 HD11 HD22 ' A' ' 64' ' ' LEU . 19.0 mt -65.06 -41.95 94.66 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.233 -0.917 . . . . 0.0 109.936 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.492 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 31.2 ttpt -48.09 -28.06 2.67 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.307 -0.871 . . . . 0.0 110.185 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -96.24 -26.7 15.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.366 -0.834 . . . . 0.0 110.259 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.416 ' HB2' ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -55.68 110.64 0.75 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.247 -0.908 . . . . 0.0 110.227 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.32 141.55 29.83 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 110.198 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.492 ' CD2' ' HA3' ' A' ' 68' ' ' GLY . 0.2 OUTLIER -166.88 109.03 0.68 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.234 -0.917 . . . . 0.0 110.143 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.447 ' O ' ' HA3' ' A' ' 116' ' ' GLY . 59.1 t -117.16 -1.69 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.191 -0.943 . . . . 0.0 110.435 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.478 ' OD1' ' CE1' ' A' ' 111' ' ' TYR . 0.6 OUTLIER 53.89 169.85 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.266 -0.896 . . . . 0.0 110.293 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -51.03 -47.96 61.57 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.266 -0.896 . . . . 0.0 110.293 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -117.9 86.51 2.54 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.265 -0.897 . . . . 0.0 110.138 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.447 ' HA3' ' O ' ' A' ' 112' ' ' VAL . . . -136.97 -170.5 11.93 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 24.1 mtmm -112.74 120.22 40.74 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.152 -1.204 . . . . 0.0 110.151 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 59.5 t0 -58.16 101.68 0.09 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.233 -0.917 . . . . 0.0 110.105 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.523 ' CD ' ' CE2' ' A' ' 71' ' ' TRP . 4.7 pp0? -141.81 10.7 2.01 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.317 -0.864 . . . . 0.0 110.325 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.518 ' O ' ' CB ' ' A' ' 124' ' ' ARG . . . -59.8 -14.91 32.16 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.548 HG12 ' N ' ' A' ' 122' ' ' ASN . 32.4 t -66.21 -76.92 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -1.079 . . . . 0.0 111.422 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.548 ' N ' HG12 ' A' ' 121' ' ' VAL . 14.5 m120 -33.01 -55.62 0.39 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.733 -0.604 . . . . 0.0 111.414 -178.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.601 ' CG2' HG12 ' A' ' 74' ' ' VAL . 9.9 p -66.69 -39.7 84.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 120.852 -1.155 . . . . 0.0 109.904 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.518 ' CB ' ' O ' ' A' ' 120' ' ' GLY . 8.9 ttp180 -62.03 -70.9 0.17 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.167 -0.958 . . . . 0.0 110.634 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.403 ' N ' ' HG2' ' A' ' 124' ' ' ARG . 21.8 mt-10 -55.2 -28.67 54.68 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.241 -0.912 . . . . 0.0 110.656 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.498 ' CB ' ' O ' ' A' ' 122' ' ' ASN . 6.1 tptp -62.35 -62.4 1.78 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.092 -1.005 . . . . 0.0 109.578 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.624 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -47.7 -40.87 21.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.356 -0.84 . . . . 0.0 110.004 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.419 ' HG3' ' HD3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -60.26 -40.31 89.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.215 -0.928 . . . . 0.0 110.381 -179.918 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -54.22 26.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.205 -0.934 . . . . 0.0 110.479 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 1.012 HD21 ' HG2' ' A' ' 81' ' ' MET . 11.7 tp -46.95 -28.98 1.81 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.171 -0.956 . . . . 0.0 109.929 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.48 HG21 ' HG2' ' A' ' 104' ' ' GLN . 28.8 t -79.98 -38.77 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.347 -0.846 . . . . 0.0 109.784 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.81 -47.94 81.16 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.327 -0.858 . . . . 0.0 110.249 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 24.9 tp -54.38 -47.79 72.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.287 -0.883 . . . . 0.0 110.399 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 1.001 HD11 HD13 ' A' ' 85' ' ' ILE . 9.3 mt -78.47 -11.31 59.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.162 -0.961 . . . . 0.0 110.237 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.512 ' CG ' ' O ' ' A' ' 135' ' ' ARG . 6.6 ttm180 -106.19 41.78 1.36 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.231 -0.918 . . . . 0.0 110.222 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.97 -44.89 5.35 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.261 -0.9 . . . . 0.0 110.38 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 50.64 -166.77 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.169 -0.957 . . . . 0.0 110.047 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.412 ' N ' ' OD1' ' A' ' 138' ' ' ASP . 32.1 p-10 -152.45 72.26 0.98 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.247 -0.908 . . . . 0.0 110.34 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -84.23 -36.18 22.92 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.323 -0.861 . . . . 0.0 110.24 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -95.6 102.46 14.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.274 -0.891 . . . . 0.0 110.223 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -90.15 42.23 1.09 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.22 -0.925 . . . . 0.0 110.161 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.428 ' O ' ' O ' ' A' ' 143' ' ' GLU . 31.8 tp10 -147.58 -45.65 0.17 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.34 -0.85 . . . . 0.0 110.226 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.428 ' O ' ' O ' ' A' ' 142' ' ' GLU . 0.2 OUTLIER 59.61 115.94 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.241 -0.912 . . . . 0.0 110.221 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.233 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 3.0 m -139.83 112.2 7.74 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.308 -1.113 . . . . 0.0 110.215 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 3.4 p -78.42 113.9 16.84 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.301 -0.874 . . . . 0.0 110.135 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -143.18 -149.51 0.27 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.185 -0.947 . . . . 0.0 110.199 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mmm -81.42 93.48 6.62 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.141 -0.974 . . . . 0.0 110.103 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.9 t -132.06 111.36 11.43 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.213 -0.929 . . . . 0.0 110.203 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.24 -168.14 2.47 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -0.875 . . . . 0.0 110.146 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -130.14 -179.13 5.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.236 -0.915 . . . . 0.0 110.27 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.5 m -131.25 -48.54 1.0 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.25 -0.906 . . . . 0.0 110.133 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.56 169.67 8.8 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.889 . . . . 0.0 110.239 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -107.97 6.33 27.06 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 110.123 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mtp180 -115.95 157.84 23.95 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.273 -0.892 . . . . 0.0 110.196 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -58.01 158.31 6.89 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 110.169 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 12.7 mtt -104.94 -157.88 0.63 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.312 -0.867 . . . . 0.0 110.188 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -78.21 -168.62 1.36 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.244 -0.91 . . . . 0.0 110.151 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.465 ' OD1' ' CD2' ' A' ' 15' ' ' HIS . 1.5 t-20 -136.93 109.28 7.33 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.248 -0.907 . . . . 0.0 110.216 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 1.034 HG22 HG23 ' A' ' 14' ' ' VAL . 2.4 mp -95.41 154.46 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.264 -0.898 . . . . 0.0 110.284 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 1.034 HG23 HG22 ' A' ' 13' ' ' ILE . 5.0 t 41.04 89.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.474 -0.766 . . . . 0.0 110.294 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.465 ' CD2' ' OD1' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -82.93 -158.12 0.26 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.189 -0.945 . . . . 0.0 110.257 -179.914 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -137.89 -84.33 0.31 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.292 -0.88 . . . . 0.0 110.127 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.462 ' CD1' ' C ' ' A' ' 17' ' ' TYR . 14.9 p90 -70.22 165.99 20.98 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 0.0 110.099 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.441 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -156.14 23.68 0.37 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.194 -0.941 . . . . 0.0 110.125 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 18' ' ' SER . 5.6 mt-10 57.07 52.69 8.78 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.331 -0.856 . . . . 0.0 110.163 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.754 ' CA ' HD13 ' A' ' 46' ' ' LEU . . . -53.31 -49.0 67.94 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.275 -0.891 . . . . 0.0 110.117 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.44 ' CG ' ' N ' ' A' ' 22' ' ' ILE . 14.4 pt-20 -44.06 -37.58 3.1 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.992 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.44 ' N ' ' CG ' ' A' ' 21' ' ' GLU . 29.3 mm -72.07 -42.63 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.322 -0.861 . . . . 0.0 110.074 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.597 ' O ' HD11 ' A' ' 39' ' ' LEU . 29.0 mmtt -56.41 -32.75 65.14 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.178 -0.951 . . . . 0.0 110.226 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.566 HG21 ' HA ' ' A' ' 56' ' ' ILE . 90.1 t -76.75 -37.46 28.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.294 -0.879 . . . . 0.0 110.191 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.3 -37.89 75.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.171 -0.956 . . . . 0.0 110.24 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -82.83 -48.85 10.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.328 -0.857 . . . . 0.0 110.164 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 1.087 ' HB2' HD12 ' A' ' 39' ' ' LEU . . . -44.6 -47.78 10.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.9 . . . . 0.0 110.17 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.48 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 4.8 p -68.57 -54.7 14.96 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.346 -0.846 . . . . 0.0 110.183 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.91 -171.79 2.42 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.304 -0.872 . . . . 0.0 110.271 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -126.86 136.39 52.27 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.277 -0.889 . . . . 0.0 110.207 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -131.77 149.15 72.62 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.206 -0.934 . . . . 0.0 110.274 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -65.64 -177.53 0.74 Allowed 'Trans proline' 0 C--N 1.305 -1.712 0 O-C-N 124.04 1.547 . . . . 0.0 110.406 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER 60.5 -152.9 0.38 Allowed 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.213 -0.93 . . . . 0.0 110.465 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.23 67.68 1.12 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -66.22 -35.7 31.45 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.963 1.507 . . . . 0.0 110.425 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.61 -178.01 3.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.181 -0.949 . . . . 0.0 110.259 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.6 t -119.77 123.71 44.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.257 -0.902 . . . . 0.0 110.255 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.2 49.84 0.4 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.231 -0.918 . . . . 0.0 110.058 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 1.087 HD12 ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER -121.12 -20.77 6.67 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.281 -0.887 . . . . 0.0 110.229 179.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -90.28 -59.38 2.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.281 -0.887 . . . . 0.0 110.203 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.07 -12.44 61.21 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.301 -0.874 . . . . 0.0 110.228 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -83.98 -66.01 0.94 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.292 -0.88 . . . . 0.0 110.336 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.598 HG21 HD11 ' A' ' 80' ' ' LEU . 79.8 mt -46.24 -38.1 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.217 -0.927 . . . . 0.0 110.094 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.752 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -68.11 -52.01 39.83 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.184 -0.948 . . . . 0.0 109.387 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.526 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 19.7 t0 -53.61 -20.84 5.68 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.064 -1.022 . . . . 0.0 108.912 179.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.754 HD13 ' CA ' ' A' ' 20' ' ' ALA . 13.4 mt -81.56 -36.41 29.11 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.578 -0.702 . . . . 0.0 110.06 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.528 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 73.1 p -52.19 -40.92 62.18 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.08 -1.013 . . . . 0.0 109.157 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.558 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 79.6 m-85 -43.22 -43.87 4.96 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 119.556 -0.857 . . . . 0.0 109.394 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 51' ' ' VAL . 1.2 t-20 -73.72 91.31 1.89 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.62 -0.675 . . . . 0.0 110.45 179.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.53 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.5 OUTLIER -11.56 -56.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 CA-C-N 115.293 -0.867 . . . . 0.0 112.696 178.183 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.548 HG12 ' N ' ' A' ' 52' ' ' ALA . 2.7 t -63.97 -65.85 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 120.972 -1.08 . . . . 0.0 110.197 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -39.33 -41.96 0.98 Allowed 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 121.241 0.543 . . . . 0.0 110.633 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.577 ' CE1' ' HA ' ' A' ' 92' ' ' VAL . 4.2 t80 -62.1 -57.57 11.09 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.458 -0.776 . . . . 0.0 110.546 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 58' ' ' SER . 0.4 OUTLIER -55.17 -24.7 28.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.21 -0.931 . . . . 0.0 110.418 -179.458 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -87.87 -25.0 23.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.247 -0.908 . . . . 0.0 110.272 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.61 HD11 ' HB3' ' A' ' 46' ' ' LEU . 19.7 mt -74.75 -70.28 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.369 -0.832 . . . . 0.0 110.426 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.465 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 4.2 mtp -45.82 -37.94 6.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.22 -0.925 . . . . 0.0 110.097 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 54' ' ' SER . 0.4 OUTLIER -53.22 -59.02 5.09 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.191 -0.943 . . . . 0.0 109.861 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -27.74 67.83 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.181 -0.949 . . . . 0.0 109.585 179.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.881 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -68.82 -29.05 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.425 -0.797 . . . . 0.0 109.705 179.539 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.418 ' CD1' ' O ' ' A' ' 57' ' ' MET . 20.9 m95 -79.08 -37.18 39.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.189 -0.944 . . . . 0.0 110.229 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -62.86 -56.76 14.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.255 -0.903 . . . . 0.0 110.314 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.43 -26.26 68.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.212 -0.93 . . . . 0.0 110.252 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.811 HD11 ' CE ' ' A' ' 81' ' ' MET . 8.4 mt -64.51 -15.43 60.85 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.287 -0.883 . . . . 0.0 110.354 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.479 ' O ' ' O ' ' A' ' 66' ' ' ASP . 1.6 m120 -110.89 41.27 1.84 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.249 -0.907 . . . . 0.0 110.354 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.605 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.5 OUTLIER -55.2 -163.0 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.338 -0.851 . . . . 0.0 110.088 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.402 ' O ' ' C ' ' A' ' 68' ' ' GLY . 0.2 OUTLIER -156.97 -170.2 3.21 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.024 -1.048 . . . . 0.0 110.671 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.402 ' C ' ' O ' ' A' ' 67' ' ' HIS . . . 45.19 -141.73 4.06 Favored Glycine 0 N--CA 1.484 1.891 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -99.61 14.92 28.33 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.495 -1.003 . . . . 0.0 109.922 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -89.67 28.37 1.33 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.259 -0.9 . . . . 0.0 110.195 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.485 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 26.0 p-90 -59.92 -15.8 24.6 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 110.067 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.485 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 4.2 tpt180 -43.47 -43.4 5.35 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.27 -0.894 . . . . 0.0 110.097 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 39.3 m170 -56.86 -47.28 80.77 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.246 -0.909 . . . . 0.0 110.063 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.8 HG11 HD22 ' A' ' 106' ' ' LEU . 59.4 t -51.87 -49.57 36.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.287 -0.883 . . . . 0.0 109.925 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.508 ' CE1' ' HG2' ' A' ' 126' ' ' LYS . 10.0 t80 -51.41 -59.84 3.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.191 -0.943 . . . . 0.0 109.925 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.48 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 8.6 mmtt -52.1 -27.0 12.52 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.905 . . . . 0.0 109.779 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.676 ' HB3' ' O ' ' A' ' 74' ' ' VAL . . . -68.31 -54.36 17.97 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.376 -0.827 . . . . 0.0 110.232 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.762 ' HE1' HG12 ' A' ' 74' ' ' VAL . 2.3 mpp? -47.09 -38.13 10.82 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.382 -0.823 . . . . 0.0 110.34 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.6 m -67.18 -38.77 85.95 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.165 -0.959 . . . . 0.0 110.212 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.881 ' CD2' HD11 ' A' ' 60' ' ' ILE . 16.7 tp -65.85 -64.58 0.83 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.224 -0.922 . . . . 0.0 109.138 179.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.811 ' CE ' HD11 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -51.86 -27.15 11.72 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.268 -0.895 . . . . 0.0 110.331 179.536 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.652 ' HB2' HD22 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -75.84 -35.47 59.96 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.006 -1.059 . . . . 0.0 110.035 179.629 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.579 ' CE2' HG21 ' A' ' 87' ' ' THR . 33.8 t80 -75.81 -58.21 3.42 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.403 -0.811 . . . . 0.0 110.58 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.572 ' HB2' HG11 ' A' ' 92' ' ' VAL . 5.3 mt -46.72 -48.49 20.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.169 -0.957 . . . . 0.0 109.83 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.044 HD13 HD21 ' A' ' 134' ' ' LEU . 63.1 mt -48.23 -43.05 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.107 -0.996 . . . . 0.0 110.322 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.3 tttp -75.55 -78.0 0.12 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.251 -0.906 . . . . 0.0 110.717 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.579 HG21 ' CE2' ' A' ' 83' ' ' TYR . 7.8 t -86.01 -25.61 25.87 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.159 -0.963 . . . . 0.0 110.764 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.752 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -43.48 -80.13 0.05 OUTLIER Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.4 t -172.25 161.6 5.38 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.175 -1.191 . . . . 0.0 110.194 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.4 -27.04 68.26 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.206 -0.934 . . . . 0.0 110.186 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.431 ' HG3' ' CD2' ' A' ' 53' ' ' PHE . 9.9 ptp180 -72.75 -34.67 67.18 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.197 -0.939 . . . . 0.0 109.852 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.577 ' HA ' ' CE1' ' A' ' 53' ' ' PHE . 54.0 t -58.4 -51.63 69.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.284 -0.885 . . . . 0.0 109.942 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.3 t -58.46 -41.36 85.02 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.177 -0.952 . . . . 0.0 109.71 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -57.95 -40.07 79.62 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.226 -0.921 . . . . 0.0 109.795 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.527 ' HA ' ' HG2' ' A' ' 98' ' ' GLU . 6.4 tp-100 -67.53 -39.37 85.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.315 -0.866 . . . . 0.0 109.397 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.62 ' SG ' HD11 ' A' ' 85' ' ' ILE . 2.7 t -56.59 -31.95 64.76 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.221 -0.924 . . . . 0.0 108.831 179.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.446 ' HA ' ' SD ' ' A' ' 100' ' ' MET . 0.8 OUTLIER -81.42 -24.92 36.58 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.512 -0.742 . . . . 0.0 109.771 179.333 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.527 ' HG2' ' HA ' ' A' ' 95' ' ' GLN . 0.1 OUTLIER -77.94 -22.84 48.95 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.245 -0.909 . . . . 0.0 109.743 179.736 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.502 ' N ' ' HG3' ' A' ' 98' ' ' GLU . 8.4 t30 -132.19 38.53 3.48 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.555 -0.716 . . . . 0.0 109.797 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.446 ' SD ' ' HA ' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -60.53 -34.72 74.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.834 . . . . 0.0 109.908 179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.456 ' O ' ' HB ' ' A' ' 105' ' ' THR . 66.3 m-85 -57.08 -27.96 62.18 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.301 -0.874 . . . . 0.0 109.688 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 1.005 ' O ' HG22 ' A' ' 105' ' ' THR . . . -71.93 -42.86 66.15 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.459 -0.775 . . . . 0.0 110.077 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.658 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 6.2 t -68.81 -28.16 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.702 ' HG2' HG21 ' A' ' 131' ' ' VAL . 1.2 mm100 -90.37 -20.66 22.58 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.915 . . . . 0.0 110.449 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 1.005 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.2 t -61.32 -22.44 64.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.198 -0.939 . . . . 0.0 110.24 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.8 HD22 HG11 ' A' ' 74' ' ' VAL . 35.3 mt -61.44 -39.12 89.65 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 110.204 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.484 ' HA ' ' HB2' ' A' ' 124' ' ' ARG . 0.2 OUTLIER -44.14 -31.06 0.86 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.209 -0.932 . . . . 0.0 110.146 179.894 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.49 -38.55 14.89 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.265 -0.897 . . . . 0.0 110.259 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -49.14 113.19 0.75 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.259 -0.901 . . . . 0.0 110.284 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.0 147.6 31.83 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.227 -0.921 . . . . 0.0 110.195 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -159.4 127.18 4.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.297 -0.877 . . . . 0.0 110.307 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.572 HG13 ' N ' ' A' ' 117' ' ' LYS . 52.1 t -128.67 -2.24 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.251 -0.906 . . . . 0.0 110.192 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.47 ' O ' ' O ' ' A' ' 112' ' ' VAL . 1.3 m-20 45.69 -172.74 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.104 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.418 ' HG3' ' OD1' ' A' ' 115' ' ' ASP . 1.0 OUTLIER -51.11 -47.75 61.87 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.188 -0.945 . . . . 0.0 110.066 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.418 ' OD1' ' HG3' ' A' ' 114' ' ' ARG . 8.1 p-10 -130.39 125.36 34.35 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.416 -0.803 . . . . 0.0 110.109 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.455 ' O ' ' OE1' ' A' ' 119' ' ' GLN . . . -174.77 -33.22 0.04 OUTLIER Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.572 ' N ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER 67.39 142.5 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.32 -1.106 . . . . 0.0 110.37 179.871 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -54.03 108.67 0.38 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.266 -0.896 . . . . 0.0 110.172 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.455 ' OE1' ' O ' ' A' ' 116' ' ' GLY . 10.9 pt20 -149.53 16.0 0.89 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.198 -0.939 . . . . 0.0 110.142 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -101.6 34.35 5.75 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.552 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p -80.11 -41.96 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -1.164 . . . . 0.0 110.148 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.552 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 2.6 m-80 -37.72 -28.31 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.816 -0.552 . . . . 0.0 110.804 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' A' ' 121' ' ' VAL . 3.8 t -81.72 -58.72 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.188 -0.945 . . . . 0.0 110.382 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.484 ' HB2' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -50.62 -30.96 14.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.222 -0.924 . . . . 0.0 110.799 -179.476 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.508 ' HG3' HG22 ' A' ' 121' ' ' VAL . 3.3 mt-10 -81.45 -53.76 6.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.221 -0.925 . . . . 0.0 111.169 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.508 ' HG2' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -51.64 -47.12 63.85 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.081 -1.012 . . . . 0.0 110.593 -179.465 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.658 ' HB1' ' O ' ' A' ' 103' ' ' VAL . . . -67.65 -41.55 83.63 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.3 -0.875 . . . . 0.0 111.003 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 124' ' ' ARG . 0.2 OUTLIER -58.53 -43.84 89.37 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.074 -1.016 . . . . 0.0 110.884 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.452 ' OE1' ' N ' ' A' ' 129' ' ' GLN . 0.5 OUTLIER -64.94 -49.44 70.36 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.086 -1.009 . . . . 0.0 110.803 -179.519 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.652 HD22 ' HB2' ' A' ' 82' ' ' GLU . 12.1 tp -51.26 -41.69 60.55 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.062 -1.024 . . . . 0.0 110.258 -179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.702 HG21 ' HG2' ' A' ' 104' ' ' GLN . 25.3 t -66.3 -32.77 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.252 -0.905 . . . . 0.0 109.878 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -65.9 -51.71 56.32 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.145 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.43 ' O ' ' C ' ' A' ' 134' ' ' LEU . 0.5 OUTLIER -61.69 -42.07 98.43 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.323 -0.86 . . . . 0.0 110.446 -179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 1.044 HD21 HD13 ' A' ' 85' ' ' ILE . 1.5 mm? -42.46 -64.48 0.6 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.309 -0.87 . . . . 0.0 110.299 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 15.6 ttp85 -114.08 63.67 0.66 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.288 -0.882 . . . . 0.0 110.201 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -76.08 -47.79 23.24 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.262 -0.899 . . . . 0.0 110.24 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -174.98 -171.63 0.54 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.194 -0.941 . . . . 0.0 110.232 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.414 ' N ' ' OD1' ' A' ' 138' ' ' ASP . 3.4 m-20 -105.34 61.16 0.68 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.286 -0.884 . . . . 0.0 110.157 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -101.75 -31.29 10.84 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.18 -0.95 . . . . 0.0 110.262 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.493 HD11 ' HB3' ' A' ' 143' ' ' GLU . 0.1 OUTLIER -111.58 105.88 14.57 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.214 -0.929 . . . . 0.0 110.287 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -114.01 -36.59 4.71 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.218 -0.926 . . . . 0.0 110.253 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -156.39 83.89 0.98 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 110.245 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.493 ' HB3' HD11 ' A' ' 140' ' ' LEU . 0.4 OUTLIER -149.56 52.23 0.94 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.196 -0.94 . . . . 0.0 110.16 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.433 ' O ' ' O ' ' A' ' 143' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.095 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.35 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 4.0 p -145.84 19.96 1.46 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.151 -1.205 . . . . 0.0 110.259 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 58.0 177.46 0.06 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.145 -0.972 . . . . 0.0 110.205 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -73.58 169.34 17.46 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.252 -0.905 . . . . 0.0 110.315 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 ptp -148.59 170.9 17.07 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.312 -0.867 . . . . 0.0 110.192 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 t -68.5 120.57 14.76 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.215 -0.928 . . . . 0.0 110.196 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 8.8 t -157.33 46.4 0.39 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.206 -0.934 . . . . 0.0 110.212 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.6 m -160.15 147.34 16.23 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.264 -0.898 . . . . 0.0 110.121 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 71.0 m -89.36 170.59 10.42 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.232 -0.917 . . . . 0.0 110.161 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.06 132.25 46.82 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.325 -0.859 . . . . 0.0 110.203 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.414 ' C ' ' HG2' ' A' ' 8' ' ' ARG . 3.6 mmt-85 -44.54 -90.66 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.27 -0.894 . . . . 0.0 110.158 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 9' ' ' GLN . 6.6 mmt180 -130.74 -143.26 0.24 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.118 -0.989 . . . . 0.0 110.153 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.416 ' C ' ' O ' ' A' ' 8' ' ' ARG . 2.8 mm-40 -42.91 148.55 0.24 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.231 -0.918 . . . . 0.0 110.234 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 11.0 ptt? -66.36 -169.65 0.08 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -83.43 -166.41 1.36 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.296 -0.878 . . . . 0.0 110.178 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -103.32 104.9 15.06 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.274 -0.891 . . . . 0.0 110.149 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 15.4 mm -103.52 160.69 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.272 -0.892 . . . . 0.0 110.286 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.6 m -47.77 115.02 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.23 -0.919 . . . . 0.0 110.262 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -83.52 72.15 10.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.219 -0.926 . . . . 0.0 110.225 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -93.02 -172.14 2.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.128 -0.983 . . . . 0.0 110.167 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.456 ' O ' ' CB ' ' A' ' 18' ' ' SER . 3.7 m-85 -78.47 168.47 19.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.216 -0.927 . . . . 0.0 110.175 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.456 ' CB ' ' O ' ' A' ' 17' ' ' TYR . 0.3 OUTLIER 172.3 -66.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.228 -0.92 . . . . 0.0 110.207 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 18' ' ' SER . 59.8 mt-10 57.25 16.55 3.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.238 -0.914 . . . . 0.0 110.385 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.481 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -58.91 -47.22 85.78 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.297 -0.877 . . . . 0.0 110.182 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.425 ' HG3' HG12 ' A' ' 22' ' ' ILE . 10.4 pt-20 -45.22 -30.95 1.33 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.275 -0.891 . . . . 0.0 109.991 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.425 HG12 ' HG3' ' A' ' 21' ' ' GLU . 27.9 mm -75.5 -44.74 40.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.345 -0.847 . . . . 0.0 110.038 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.483 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 2.9 mmtp -55.53 -51.88 65.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.244 -0.91 . . . . 0.0 110.003 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.833 HG21 ' HA ' ' A' ' 56' ' ' ILE . 98.7 t -58.57 -37.63 66.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.224 -0.923 . . . . 0.0 110.064 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -69.05 0.13 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.253 -0.904 . . . . 0.0 109.977 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -64.08 -13.64 48.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.423 -0.798 . . . . 0.0 110.199 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.863 ' HB2' HD12 ' A' ' 39' ' ' LEU . . . -77.0 -30.3 55.85 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.249 -0.907 . . . . 0.0 110.082 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.492 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 32.7 p -99.74 34.23 2.32 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.304 -0.872 . . . . 0.0 110.031 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.8 p -172.11 125.99 0.55 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.254 -0.904 . . . . 0.0 109.945 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -151.9 150.71 30.37 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.161 -0.962 . . . . 0.0 110.453 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.596 ' CB ' ' CD ' ' A' ' 32' ' ' PRO . 0.8 OUTLIER -175.27 -61.54 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.339 -0.851 . . . . 0.0 110.002 179.82 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.596 ' CD ' ' CB ' ' A' ' 31' ' ' ASP . 29.4 Cg_endo -69.12 168.66 20.07 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 O-C-N 123.927 1.488 . . . . 0.0 110.174 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.416 ' O ' ' O ' ' A' ' 32' ' ' PRO . 0.5 OUTLIER 53.07 172.99 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.265 -0.897 . . . . 0.0 110.661 179.816 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.407 ' HA3' ' HD2' ' A' ' 35' ' ' PRO . . . -79.98 -142.65 2.84 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.407 ' HD2' ' HA3' ' A' ' 34' ' ' GLY . 18.9 Cg_endo -66.09 -175.36 0.49 Allowed 'Trans proline' 0 C--N 1.306 -1.71 0 O-C-N 124.026 1.54 . . . . 0.0 110.39 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.58 -177.44 3.36 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.263 -0.898 . . . . 0.0 110.229 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.5 m -110.38 -77.22 0.6 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.267 -0.896 . . . . 0.0 110.209 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.45 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.3 m -130.71 76.2 1.71 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.238 -0.914 . . . . 0.0 110.247 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.863 HD12 ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -102.73 -47.92 4.26 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.915 . . . . 0.0 110.247 179.949 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.35 -53.75 9.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.268 -0.895 . . . . 0.0 110.235 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.3 t -56.75 -27.46 59.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.198 -0.939 . . . . 0.0 110.207 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 38' ' ' SER . 0.0 OUTLIER -78.16 -50.19 12.43 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.3 -0.875 . . . . 0.0 110.233 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.732 HG21 HD11 ' A' ' 80' ' ' LEU . 82.1 mt -56.31 -36.48 46.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.201 -0.937 . . . . 0.0 110.012 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.638 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -67.65 -49.85 60.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.303 -0.873 . . . . 0.0 109.654 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.482 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 25.8 t70 -55.31 -18.86 7.12 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.124 -0.985 . . . . 0.0 109.141 179.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.507 ' HB3' ' HB1' ' A' ' 52' ' ' ALA . 10.7 mt -85.32 -34.22 21.91 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.529 -0.732 . . . . 0.0 110.119 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.525 HG21 HG21 ' A' ' 92' ' ' VAL . 76.1 p -56.23 -41.08 75.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.153 -0.967 . . . . 0.0 109.521 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.582 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 85.4 m-85 -43.3 -43.69 5.06 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 119.776 -0.77 . . . . 0.0 109.195 179.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.479 ' HB2' ' O ' ' A' ' 46' ' ' LEU . 5.6 m-20 -58.87 -160.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.662 0.744 . . . . 0.0 110.051 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 m -122.01 -32.35 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.547 HG12 ' N ' ' A' ' 52' ' ' ALA . 10.6 t -85.64 -70.86 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.471 0 CA-C-O 121.947 0.88 . . . . 0.0 109.806 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.567 ' O ' HD12 ' A' ' 56' ' ' ILE . . . -38.31 -40.38 0.52 Allowed 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.787 -177.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.669 ' CE1' HG22 ' A' ' 92' ' ' VAL . 7.4 t80 -55.39 -58.86 6.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.257 -0.902 . . . . 0.0 110.291 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 58' ' ' SER . 67.3 m -55.62 -41.08 72.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.18 -0.95 . . . . 0.0 110.086 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.6 -25.08 67.24 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.359 -0.838 . . . . 0.0 109.971 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.833 ' HA ' HG21 ' A' ' 24' ' ' VAL . 10.8 mt -79.33 -70.4 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.404 -0.81 . . . . 0.0 110.144 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.445 ' HA ' ' HB ' ' A' ' 60' ' ' ILE . 15.3 mtp -47.96 -39.82 20.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.192 -0.943 . . . . 0.0 109.596 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.447 ' HB2' ' O ' ' A' ' 54' ' ' SER . 38.5 t -53.42 -57.29 11.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.325 -0.86 . . . . 0.0 109.762 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.445 ' HB2' HG11 ' A' ' 24' ' ' VAL . 8.8 mmt -62.17 -23.17 66.44 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.232 -0.918 . . . . 0.0 109.596 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.69 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -72.42 -31.74 39.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.405 -0.81 . . . . 0.0 109.29 179.524 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -74.7 -44.99 47.29 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.352 -0.842 . . . . 0.0 109.722 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.59 -52.93 61.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.254 -0.904 . . . . 0.0 109.705 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.52 ' HD3' ' CD2' ' A' ' 73' ' ' HIS . 14.5 mmp_? -62.7 -35.79 80.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.229 -0.92 . . . . 0.0 109.713 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 1.031 ' O ' HG22 ' A' ' 74' ' ' VAL . 4.1 mt -54.4 -24.02 18.15 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.351 -0.843 . . . . 0.0 110.052 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -122.02 48.82 1.65 Allowed 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.469 -0.769 . . . . 0.0 109.141 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.519 ' HB2' ' HB3' ' A' ' 73' ' ' HIS . 0.7 OUTLIER -82.71 165.34 20.03 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.475 -0.766 . . . . 0.0 110.855 -178.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.462 ' O ' ' O ' ' A' ' 66' ' ' ASP . 22.2 m170 54.13 165.18 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.691 -0.631 . . . . 0.0 110.362 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.574 ' O ' ' CE1' ' A' ' 109' ' ' PHE . . . -58.47 -95.83 0.01 OUTLIER Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.577 ' HA ' ' CE1' ' A' ' 109' ' ' PHE . 27.3 ttmt -104.71 20.85 17.92 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.708 -0.878 . . . . 0.0 110.457 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.549 ' HA ' ' HB2' ' A' ' 111' ' ' TYR . 1.4 t-20 -76.8 146.97 37.5 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.491 -0.755 . . . . 0.0 110.741 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.59 ' CD1' ' HA2' ' A' ' 120' ' ' GLY . 58.4 p-90 -110.55 18.2 19.98 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.424 -0.798 . . . . 0.0 110.468 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.0 mmt180 -71.44 -70.35 0.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.188 -0.945 . . . . 0.0 110.492 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.52 ' CD2' ' HD3' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -55.98 -49.46 73.52 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.214 -0.929 . . . . 0.0 110.138 -179.851 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 1.031 HG22 ' O ' ' A' ' 64' ' ' LEU . 68.8 t -44.0 -53.01 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.434 -0.791 . . . . 0.0 110.488 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.511 ' CE1' ' HG3' ' A' ' 126' ' ' LYS . 5.3 t80 -49.68 -56.27 10.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.273 -0.892 . . . . 0.0 110.196 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.492 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -56.59 -28.53 60.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.201 -0.937 . . . . 0.0 110.144 179.945 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.886 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -71.14 -34.92 71.48 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.361 -0.837 . . . . 0.0 109.81 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.838 ' HE1' HG22 ' A' ' 123' ' ' VAL . 0.6 OUTLIER -61.8 -38.9 89.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.472 -0.768 . . . . 0.0 109.715 179.52 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 40.9 m -61.04 -63.91 1.13 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.278 -0.889 . . . . 0.0 110.058 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.749 HD21 HG22 ' A' ' 24' ' ' VAL . 20.1 tp -47.35 -54.1 12.03 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.212 -0.93 . . . . 0.0 110.068 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.873 ' HG2' HD22 ' A' ' 130' ' ' LEU . 3.7 ttp -50.76 -37.25 40.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.193 -0.942 . . . . 0.0 110.365 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.538 ' HA ' HD21 ' A' ' 130' ' ' LEU . 26.2 tt0 -74.17 -68.58 0.51 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.096 -1.003 . . . . 0.0 110.574 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.565 ' CE2' HG21 ' A' ' 87' ' ' THR . 55.0 t80 -37.58 -45.91 0.8 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.494 -0.754 . . . . 0.0 111.367 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.558 ' CB ' HG11 ' A' ' 92' ' ' VAL . 75.6 mt -66.68 -42.31 86.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.14 -0.975 . . . . 0.0 110.695 -179.243 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.909 HD13 HD11 ' A' ' 134' ' ' LEU . 32.3 mt -52.73 -19.91 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 120.933 -1.104 . . . . 0.0 110.158 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.82 -87.96 0.44 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.297 -0.877 . . . . 0.0 110.293 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.565 HG21 ' CE2' ' A' ' 83' ' ' TYR . 14.9 t -69.41 -6.21 28.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.224 -0.922 . . . . 0.0 110.222 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.638 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -72.19 -78.74 0.48 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 4.3 t -174.81 157.01 2.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.11 -1.229 . . . . 0.0 110.234 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.92 -21.84 65.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.302 -0.874 . . . . 0.0 110.191 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.28 -39.5 59.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.22 -0.925 . . . . 0.0 110.08 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.669 HG22 ' CE1' ' A' ' 53' ' ' PHE . 78.4 t -58.69 -31.48 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.289 -0.882 . . . . 0.0 110.074 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 29.6 p -79.06 -38.69 35.79 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.159 -0.963 . . . . 0.0 110.018 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -59.67 -59.37 5.55 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.283 -0.885 . . . . 0.0 109.832 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.42 -35.85 63.37 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.481 -0.762 . . . . 0.0 109.8 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.562 ' HB3' HD13 ' A' ' 134' ' ' LEU . 11.6 m -60.91 -36.38 79.12 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.19 -0.944 . . . . 0.0 109.713 179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.498 ' HG3' ' HG2' ' A' ' 135' ' ' ARG . 29.9 ttpt -73.83 -26.63 60.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.403 -0.811 . . . . 0.0 109.589 179.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -81.85 -22.84 36.76 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.373 -0.829 . . . . 0.0 110.057 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -111.52 34.75 3.95 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.286 -0.884 . . . . 0.0 110.34 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 5.6 ptp -60.97 -31.06 70.65 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.215 -0.928 . . . . 0.0 110.17 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -61.42 -26.27 67.75 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.888 . . . . 0.0 110.2 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 1.022 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.65 -40.75 48.15 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.244 -0.91 . . . . 0.0 110.15 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.573 HG22 ' HE1' ' A' ' 81' ' ' MET . 5.3 t -72.12 -27.46 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.376 -0.828 . . . . 0.0 110.151 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.73 ' NE2' HG11 ' A' ' 131' ' ' VAL . 15.5 mm-40 -82.18 -26.89 32.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.174 -0.954 . . . . 0.0 110.315 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 1.022 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.1 t -64.85 -12.64 50.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.128 -0.983 . . . . 0.0 110.04 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 1.002 HD11 HD22 ' A' ' 64' ' ' LEU . 65.4 mt -77.23 -33.17 56.18 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.274 -0.891 . . . . 0.0 110.181 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.536 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 1.2 ttmt -41.41 -27.47 0.09 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.378 -0.827 . . . . 0.0 110.464 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.435 ' N ' ' O ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -90.03 -37.91 13.97 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.257 -0.902 . . . . 0.0 110.276 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.577 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -41.62 100.88 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.3 -0.875 . . . . 0.0 110.58 -179.847 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.457 ' O ' ' CG ' ' A' ' 110' ' ' GLN . 6.0 pt20 -153.0 84.16 1.21 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.329 -0.857 . . . . 0.0 110.353 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.549 ' HB2' ' HA ' ' A' ' 70' ' ' ASN . 0.5 OUTLIER -77.33 124.54 28.0 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.2 -0.937 . . . . 0.0 109.85 179.814 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.69 HG22 ' N ' ' A' ' 117' ' ' LYS . 3.4 p -113.23 -11.7 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.118 -0.988 . . . . 0.0 110.589 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.529 ' CB ' ' OD1' ' A' ' 115' ' ' ASP . 1.2 m-20 55.58 -178.37 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.371 -0.831 . . . . 0.0 110.572 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.502 ' HD2' ' N ' ' A' ' 115' ' ' ASP . 5.0 ppt_? -55.42 -45.19 76.76 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.32 -0.863 . . . . 0.0 110.913 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.529 ' OD1' ' CB ' ' A' ' 113' ' ' ASP . 5.2 p-10 -38.99 -28.24 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.401 -0.812 . . . . 0.0 110.741 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 114' ' ' ARG . . . 63.09 39.6 98.2 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.69 ' N ' HG22 ' A' ' 112' ' ' VAL . 2.2 mmtt -107.07 97.58 7.34 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.324 -1.103 . . . . 0.0 110.177 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -56.2 114.02 1.8 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.202 -0.936 . . . . 0.0 110.167 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.423 ' OE1' ' HB3' ' A' ' 117' ' ' LYS . 10.9 pt20 -152.64 27.23 0.56 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.256 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.59 ' HA2' ' CD1' ' A' ' 71' ' ' TRP . . . -111.71 62.82 0.29 Allowed Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.542 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 2.8 p -113.14 -41.47 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 O-C-N 121.245 -1.15 . . . . 0.0 110.146 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.542 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 1.0 OUTLIER -36.13 -31.2 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.833 -0.542 . . . . 0.0 110.775 -179.669 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.838 HG22 ' HE1' ' A' ' 78' ' ' MET . 1.0 OUTLIER -82.19 -46.07 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.263 -0.898 . . . . 0.0 109.917 179.783 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.536 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -57.35 -30.88 65.2 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.203 -0.936 . . . . 0.0 110.61 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.457 ' OE1' HG13 ' A' ' 121' ' ' VAL . 44.8 mt-10 -82.71 -54.75 4.89 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.196 -0.94 . . . . 0.0 111.055 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.511 ' HG3' ' CE1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -52.62 -49.64 64.71 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.096 -1.002 . . . . 0.0 110.235 -179.631 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.523 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -61.14 -41.62 97.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.314 -0.866 . . . . 0.0 110.431 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 124' ' ' ARG . 2.4 ttmt -56.9 -49.66 74.91 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.161 -0.962 . . . . 0.0 110.369 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -55.2 -49.59 71.54 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 110.379 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.873 HD22 ' HG2' ' A' ' 81' ' ' MET . 0.3 OUTLIER -53.29 -40.82 65.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.161 -0.962 . . . . 0.0 110.161 -179.916 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.73 HG11 ' NE2' ' A' ' 104' ' ' GLN . 26.4 t -72.75 -25.91 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.356 -0.84 . . . . 0.0 110.191 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.45 ' O ' ' OD1' ' A' ' 136' ' ' ASP . . . -70.23 -56.17 7.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.218 -0.926 . . . . 0.0 110.389 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 15.7 tp -69.9 -37.8 76.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.289 -0.882 . . . . 0.0 110.377 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.909 HD11 HD13 ' A' ' 85' ' ' ILE . 30.9 mt -70.83 -68.07 0.46 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.154 -0.966 . . . . 0.0 110.206 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.498 ' HG2' ' HG3' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -92.84 113.17 25.38 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.15 -0.969 . . . . 0.0 110.187 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.45 ' OD1' ' O ' ' A' ' 132' ' ' ALA . 0.4 OUTLIER -144.16 -66.44 0.35 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.243 -0.911 . . . . 0.0 110.352 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -167.6 64.8 0.08 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 110.281 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.87 118.98 4.4 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.25 -0.906 . . . . 0.0 110.376 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -96.17 -158.48 0.66 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.31 -0.869 . . . . 0.0 110.175 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.441 ' O ' ' O ' ' A' ' 141' ' ' ARG . 0.9 OUTLIER -169.87 151.99 4.32 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.242 -0.912 . . . . 0.0 110.272 179.855 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.441 ' O ' ' O ' ' A' ' 140' ' ' LEU . 0.5 OUTLIER -56.36 -162.44 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.206 -0.934 . . . . 0.0 110.339 -179.846 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 141' ' ' ARG . 2.3 tm-20 63.81 19.25 11.64 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 110.17 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -159.39 -168.65 2.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.304 -0.873 . . . . 0.0 110.25 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.219 179.949 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 1.9 m -99.71 171.89 7.62 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -1.131 . . . . 0.0 110.303 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.84 88.36 2.73 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.289 -0.882 . . . . 0.0 110.177 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -85.94 173.57 9.86 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.229 -0.92 . . . . 0.0 110.246 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.47 134.74 49.81 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.248 -0.908 . . . . 0.0 110.131 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 m 60.45 59.27 2.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.307 -0.871 . . . . 0.0 110.255 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.403 ' O ' ' C ' ' A' ' 4' ' ' SER . 1.7 m -110.67 144.31 39.8 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.884 . . . . 0.0 110.275 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.403 ' C ' ' O ' ' A' ' 3' ' ' THR . 94.7 p 44.15 51.38 7.33 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.284 -0.885 . . . . 0.0 110.168 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.455 ' O ' ' O ' ' A' ' 6' ' ' LEU . 9.4 t -73.15 -45.14 58.4 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -0.931 . . . . 0.0 110.139 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' A' ' 5' ' ' SER . 0.2 OUTLIER 51.76 102.78 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.31 -0.869 . . . . 0.0 110.313 179.968 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -85.84 -165.4 1.23 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.328 -0.857 . . . . 0.0 110.193 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -99.24 153.35 19.01 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.186 -0.946 . . . . 0.0 110.096 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 98.4 mm-40 -90.75 148.89 22.27 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.244 -0.91 . . . . 0.0 110.253 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 99.3 mmm -126.12 -74.29 0.6 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.295 -0.878 . . . . 0.0 110.179 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.0 pttt -47.6 -48.77 28.1 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.24 -0.913 . . . . 0.0 110.499 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 59.4 106.68 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 110.073 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.0 mp -92.32 137.56 21.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.294 -0.879 . . . . 0.0 110.376 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.5 t -104.83 65.16 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.316 -0.865 . . . . 0.0 110.179 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -98.21 -166.24 1.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.251 -0.906 . . . . 0.0 110.306 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.466 ' HB3' ' CB ' ' A' ' 19' ' ' GLU . 25.5 m-20 -83.14 115.98 22.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.244 -0.91 . . . . 0.0 110.222 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -87.65 159.77 18.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.282 -0.886 . . . . 0.0 110.175 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 70.5 m 45.78 27.14 0.43 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -0.93 . . . . 0.0 110.072 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.466 ' CB ' ' HB3' ' A' ' 16' ' ' ASN . 3.4 mt-10 -110.76 -25.11 10.08 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.21 -0.931 . . . . 0.0 110.182 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.953 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -65.01 -52.97 53.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.233 -0.917 . . . . 0.0 110.15 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.409 ' CG ' ' N ' ' A' ' 22' ' ' ILE . 12.5 pt-20 -50.1 -34.1 20.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.236 -0.915 . . . . 0.0 110.053 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.409 ' N ' ' CG ' ' A' ' 21' ' ' GLU . 13.4 mt -66.07 -39.41 84.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.255 -0.903 . . . . 0.0 109.934 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.457 ' CB ' HG12 ' A' ' 43' ' ' ILE . 1.6 mmtm -67.11 -39.55 86.69 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.296 -0.877 . . . . 0.0 110.017 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.768 HG13 HD23 ' A' ' 80' ' ' LEU . 56.1 t -57.83 -38.68 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.353 -0.842 . . . . 0.0 110.091 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.508 ' HD3' ' CZ ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -63.35 -50.68 69.01 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.281 -0.887 . . . . 0.0 110.157 179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 49.1 tt0 -68.95 -17.05 63.89 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.432 -0.793 . . . . 0.0 109.959 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.737 ' HB2' ' CD2' ' A' ' 39' ' ' LEU . . . -79.78 -33.16 40.79 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.343 -0.848 . . . . 0.0 110.147 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.497 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 82.3 p -93.32 34.55 1.14 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.211 -0.93 . . . . 0.0 110.107 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.43 ' HB2' ' O ' ' A' ' 28' ' ' THR . 2.6 t -177.95 55.17 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.361 -0.837 . . . . 0.0 110.129 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -114.23 77.25 1.04 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.292 -0.88 . . . . 0.0 110.275 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.557 ' N ' ' CD ' ' A' ' 32' ' ' PRO . 0.1 OUTLIER -77.43 -48.23 2.4 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.279 -0.888 . . . . 0.0 110.186 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.557 ' CD ' ' N ' ' A' ' 31' ' ' ASP . 22.4 Cg_exo -60.08 176.5 0.73 Allowed 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 123.978 1.514 . . . . 0.0 110.382 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.411 ' HB2' ' O ' ' A' ' 32' ' ' PRO . 0.8 OUTLIER 63.58 171.78 0.16 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.193 -0.942 . . . . 0.0 110.563 179.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.76 179.16 1.5 Allowed Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.42 -73.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.773 0 O-C-N 124.016 1.535 . . . . 0.0 110.178 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.7 t -66.72 154.07 41.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.26 -0.9 . . . . 0.0 110.105 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.38 157.76 44.76 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.156 -0.965 . . . . 0.0 110.197 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.2 t -87.09 41.04 0.95 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.233 -0.917 . . . . 0.0 110.193 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.737 ' CD2' ' HB2' ' A' ' 27' ' ' ALA . 0.8 OUTLIER -114.79 -23.36 9.21 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.301 -0.874 . . . . 0.0 110.22 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 5.4 mtt -67.48 -62.2 1.53 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.171 -0.955 . . . . 0.0 110.234 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.44 -24.2 7.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.263 -0.898 . . . . 0.0 110.267 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.83 -54.02 8.06 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.156 -0.965 . . . . 0.0 110.176 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.589 HD11 ' HB2' ' A' ' 27' ' ' ALA . 79.3 mt -52.96 -32.85 18.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.149 -0.969 . . . . 0.0 109.951 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.527 ' HB2' HD23 ' A' ' 84' ' ' LEU . . . -70.23 -52.91 19.54 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.182 -0.949 . . . . 0.0 109.62 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.598 ' HA ' ' CD1' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -51.55 -21.46 2.52 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.021 -1.049 . . . . 0.0 109.455 179.268 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.953 HD22 ' HB2' ' A' ' 20' ' ' ALA . 4.6 mt -76.92 -40.97 45.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.429 -0.794 . . . . 0.0 110.133 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.689 HG21 ' CG2' ' A' ' 92' ' ' VAL . 42.9 p -53.97 -43.07 69.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.257 -0.902 . . . . 0.0 109.712 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.598 ' CD1' ' HA ' ' A' ' 45' ' ' ASP . 81.6 m-85 -40.48 -38.96 0.92 Allowed 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 119.945 -0.702 . . . . 0.0 109.529 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.466 ' O ' ' O ' ' A' ' 48' ' ' TYR . 13.7 m120 -58.08 -152.71 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.69 0.757 . . . . 0.0 110.168 179.057 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.7 t -128.11 -15.89 2.68 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.878 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.275 -177.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.646 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 0.3 OUTLIER -110.14 -48.1 6.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 CA-C-O 122.42 1.105 . . . . 0.0 108.569 179.151 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.695 ' HB1' ' HB3' ' A' ' 46' ' ' LEU . . . -48.82 -47.27 42.54 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.37 -178.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.548 ' HB2' ' HA ' ' A' ' 47' ' ' THR . 2.1 t80 -56.88 -54.7 43.48 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.374 -0.829 . . . . 0.0 109.819 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -59.88 -21.62 61.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.276 -0.89 . . . . 0.0 110.325 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' A' ' 51' ' ' VAL . 2.8 mm-40 -90.72 -19.6 23.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.309 -0.87 . . . . 0.0 110.048 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.629 HG21 HD13 ' A' ' 84' ' ' LEU . 7.3 mt -80.77 -70.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.383 -0.823 . . . . 0.0 110.0 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.574 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 95.8 mmm -45.17 -35.57 3.31 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 t -56.9 -59.56 4.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.345 -0.847 . . . . 0.0 109.806 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.451 ' HB3' HG11 ' A' ' 24' ' ' VAL . 0.0 OUTLIER -59.08 -25.64 63.96 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.333 -0.854 . . . . 0.0 109.966 179.653 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.692 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -74.15 -29.97 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.364 -0.835 . . . . 0.0 109.936 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.574 ' CD1' ' O ' ' A' ' 57' ' ' MET . 18.2 m95 -76.07 -44.76 37.43 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.158 -0.964 . . . . 0.0 110.387 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.27 -49.06 79.11 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.222 -0.924 . . . . 0.0 110.434 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.508 ' CZ ' ' HD3' ' A' ' 25' ' ' ARG . 12.5 mmt85 -70.6 -32.02 69.23 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.22 -0.925 . . . . 0.0 110.32 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.995 HD22 HD11 ' A' ' 106' ' ' LEU . 3.9 mt -57.0 -18.67 14.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.319 -0.863 . . . . 0.0 110.503 -179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.446 ' O ' ' O ' ' A' ' 66' ' ' ASP . 19.0 t30 -104.53 37.93 2.01 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.238 -0.914 . . . . 0.0 109.935 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.472 ' OD2' ' HB3' ' A' ' 70' ' ' ASN . 1.0 OUTLIER -54.85 -165.99 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.362 -0.836 . . . . 0.0 110.181 -179.845 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.74 178.64 6.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.352 -0.842 . . . . 0.0 110.217 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -73.6 -54.09 6.93 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.626 -1.389 . . . . 0.0 109.626 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -64.04 -39.14 93.44 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.247 -1.149 . . . . 0.0 110.369 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.472 ' HB3' ' OD2' ' A' ' 66' ' ' ASP . 2.4 m120 -92.33 43.01 1.12 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.263 -0.898 . . . . 0.0 110.361 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 47.4 p-90 -65.97 -9.07 26.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.237 -0.914 . . . . 0.0 110.324 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 73' ' ' HIS . 1.3 ptp180 -55.56 -27.11 47.15 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.255 -0.903 . . . . 0.0 110.224 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.448 ' HB2' ' CG ' ' A' ' 66' ' ' ASP . 0.1 OUTLIER -72.71 -36.14 67.74 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 109.986 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.705 HG12 ' HE2' ' A' ' 78' ' ' MET . 55.6 t -62.62 -59.16 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.318 -0.864 . . . . 0.0 110.024 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.639 ' CE1' ' CG ' ' A' ' 126' ' ' LYS . 15.8 t80 -46.78 -43.57 18.36 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.253 -0.904 . . . . 0.0 110.055 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.497 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 7.5 mmtp -65.18 -37.11 86.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.256 -0.902 . . . . 0.0 110.166 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.742 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -65.9 -27.24 68.05 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.224 -0.922 . . . . 0.0 110.015 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.785 ' SD ' ' HB2' ' A' ' 127' ' ' ALA . 0.0 OUTLIER -71.4 -39.39 71.17 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.363 -0.836 . . . . 0.0 110.396 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 39.1 m -63.68 -35.81 81.77 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.168 -0.958 . . . . 0.0 110.129 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.768 HD23 HG13 ' A' ' 24' ' ' VAL . 33.3 tp -75.98 -37.38 58.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.145 -0.972 . . . . 0.0 109.614 179.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.558 ' HE2' HD11 ' A' ' 64' ' ' LEU . 3.4 ttp -72.7 -20.85 61.15 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.269 -0.894 . . . . 0.0 109.97 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.58 ' CA ' HD11 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -89.79 -36.29 15.22 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.266 -0.896 . . . . 0.0 110.244 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.633 ' CE1' ' CG2' ' A' ' 87' ' ' THR . 22.6 t80 -73.25 -42.25 62.76 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.363 -0.835 . . . . 0.0 110.698 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.65 ' CB ' HG11 ' A' ' 92' ' ' VAL . 57.4 mt -67.4 -30.12 69.79 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.255 -0.903 . . . . 0.0 110.365 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.015 HG21 HD11 ' A' ' 134' ' ' LEU . 17.7 mt -68.66 -13.11 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.084 -1.01 . . . . 0.0 110.039 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.67 -66.96 0.91 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.26 -0.9 . . . . 0.0 109.971 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.633 ' CG2' ' CE1' ' A' ' 83' ' ' TYR . 11.5 t -97.13 8.11 45.21 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.341 -0.849 . . . . 0.0 109.94 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.619 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -95.93 30.81 7.97 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.516 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.8 OUTLIER 72.29 156.98 0.17 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.305 -1.115 . . . . 0.0 110.288 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 94' ' ' GLN . 6.8 mt-10 -68.43 -9.96 52.01 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.275 -0.89 . . . . 0.0 110.507 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -69.59 -45.53 68.39 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.305 -0.872 . . . . 0.0 109.638 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.689 ' CG2' HG21 ' A' ' 47' ' ' THR . 99.3 t -52.76 -40.53 35.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 121.503 -0.748 . . . . 0.0 109.768 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.8 m -68.48 -39.32 81.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.296 -0.878 . . . . 0.0 109.506 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 90' ' ' GLU . 8.7 mt-30 -55.85 -35.5 66.5 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.331 -0.856 . . . . 0.0 109.397 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.535 ' HA ' ' HG2' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -70.08 -40.2 75.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.451 -0.78 . . . . 0.0 109.014 178.956 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.492 ' SG ' HD22 ' A' ' 134' ' ' LEU . 21.7 t -55.3 -31.95 62.05 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.239 -0.913 . . . . 0.0 108.959 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.9 mttt -82.14 -25.87 34.0 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.567 -0.708 . . . . 0.0 109.924 179.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.535 ' HG2' ' HA ' ' A' ' 95' ' ' GLN . 0.0 OUTLIER -75.36 -21.98 57.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 109.856 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.504 ' N ' ' HG3' ' A' ' 98' ' ' GLU . 22.6 t-20 -140.77 44.79 1.82 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.407 -0.808 . . . . 0.0 109.977 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.473 ' SD ' ' HD3' ' A' ' 135' ' ' ARG . 28.5 ttp -59.92 -36.07 76.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.248 -0.908 . . . . 0.0 110.025 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.448 ' O ' ' HB ' ' A' ' 105' ' ' THR . 8.7 m-30 -57.62 -27.04 62.42 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.389 -0.819 . . . . 0.0 109.972 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.984 ' O ' HG22 ' A' ' 105' ' ' THR . . . -69.06 -41.5 77.51 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.385 -0.822 . . . . 0.0 110.085 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.463 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 3.4 t -73.88 -29.7 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.373 -0.83 . . . . 0.0 109.84 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.627 ' HG2' HG21 ' A' ' 131' ' ' VAL . 7.5 mt-30 -83.45 -20.18 34.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.417 -0.802 . . . . 0.0 110.219 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.984 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.5 t -72.34 -20.0 61.55 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.255 -0.903 . . . . 0.0 110.19 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.995 HD11 HD22 ' A' ' 64' ' ' LEU . 12.2 mt -64.3 -39.75 94.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.267 -0.896 . . . . 0.0 109.937 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -52.56 -25.47 10.59 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.271 -0.893 . . . . 0.0 110.143 179.885 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.442 ' N ' ' HG3' ' A' ' 107' ' ' LYS . 0.8 OUTLIER -84.27 -35.88 23.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 179.795 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.409 ' C ' ' O ' ' A' ' 108' ' ' ASP . 0.5 OUTLIER -43.08 102.41 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.354 -0.841 . . . . 0.0 110.217 179.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 108' ' ' ASP . 12.6 pt20 -145.76 154.98 42.64 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.23 -0.919 . . . . 0.0 110.206 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -162.91 101.69 1.0 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.294 -0.879 . . . . 0.0 110.168 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.64 HG21 ' OD1' ' A' ' 118' ' ' ASP . 2.0 p -144.17 19.19 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.341 -0.85 . . . . 0.0 110.283 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -54.74 -55.94 24.52 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.237 -0.914 . . . . 0.0 110.198 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.521 ' HG3' ' N ' ' A' ' 115' ' ' ASP . 0.1 OUTLIER -96.96 -45.74 6.48 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.252 -0.905 . . . . 0.0 110.325 -179.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.521 ' N ' ' HG3' ' A' ' 114' ' ' ARG . 0.1 OUTLIER -49.06 -61.25 2.17 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.382 -0.824 . . . . 0.0 110.202 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.529 ' CA ' HG22 ' A' ' 112' ' ' VAL . . . 94.55 -16.89 60.17 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.8 mttm -88.32 109.93 20.36 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.254 -1.145 . . . . 0.0 110.25 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.64 ' OD1' HG21 ' A' ' 112' ' ' VAL . 1.2 m-20 -84.82 64.27 8.5 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.258 -0.901 . . . . 0.0 110.201 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.28 21.96 10.27 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.176 -0.953 . . . . 0.0 110.156 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -95.84 18.84 56.67 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.456 -1.458 . . . . 0.0 109.456 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.564 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.6 p -83.8 -43.55 17.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.263 -1.14 . . . . 0.0 110.223 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.564 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 0.7 OUTLIER -39.37 -44.01 1.27 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.59 -0.694 . . . . 0.0 110.61 -179.843 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.65 HG13 ' HE1' ' A' ' 78' ' ' MET . 1.4 t -78.86 -48.67 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.339 -0.85 . . . . 0.0 110.202 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.445 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -44.04 -51.05 8.14 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.272 -0.893 . . . . 0.0 111.201 -179.365 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.486 ' OE2' ' HA ' ' A' ' 122' ' ' ASN . 14.2 pt-20 -72.72 -34.26 66.99 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.273 -0.892 . . . . 0.0 111.186 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.744 ' HB3' ' HE3' ' A' ' 78' ' ' MET . 0.8 OUTLIER -59.04 -54.6 45.29 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.972 -1.08 . . . . 0.0 110.289 -179.776 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.785 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -59.83 -42.94 94.66 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.338 -0.851 . . . . 0.0 110.488 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 9.6 tttp -60.5 -34.62 74.34 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.236 -0.915 . . . . 0.0 110.477 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.537 ' O ' ' HB3' ' A' ' 132' ' ' ALA . 1.9 mt-30 -65.48 -42.87 91.72 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.298 -0.876 . . . . 0.0 110.48 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.846 HD21 HD12 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -58.14 -56.09 26.53 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.034 -1.042 . . . . 0.0 109.948 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.627 HG21 ' HG2' ' A' ' 104' ' ' GLN . 55.4 t -53.78 -23.6 8.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.449 -0.782 . . . . 0.0 109.837 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 129' ' ' GLN . . . -76.22 -56.12 4.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.447 -0.783 . . . . 0.0 110.503 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.98 -34.16 54.67 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.342 -0.849 . . . . 0.0 110.582 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 1.015 HD11 HG21 ' A' ' 85' ' ' ILE . 0.2 OUTLIER -79.63 -58.95 2.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.188 -0.945 . . . . 0.0 110.451 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.473 ' HD3' ' SD ' ' A' ' 100' ' ' MET . 3.7 ttp180 -92.09 48.23 1.4 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.282 -0.886 . . . . 0.0 110.367 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 132' ' ' ALA . 11.7 t70 -84.83 -43.05 14.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.197 -0.939 . . . . 0.0 110.224 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -119.16 -179.73 3.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.183 -0.948 . . . . 0.0 110.19 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -90.39 178.91 6.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.25 -0.906 . . . . 0.0 110.148 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -53.59 114.6 1.59 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.269 -0.894 . . . . 0.0 110.088 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.473 HD23 ' HG3' ' A' ' 143' ' ' GLU . 4.6 tp -164.05 128.54 2.75 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 110.294 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 142' ' ' GLU . 0.0 OUTLIER -91.62 167.33 12.29 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.298 -0.876 . . . . 0.0 110.074 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.459 ' CB ' ' O ' ' A' ' 141' ' ' ARG . 0.0 OUTLIER 65.55 61.55 0.69 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.178 -0.951 . . . . 0.0 110.193 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.473 ' HG3' HD23 ' A' ' 140' ' ' LEU . 8.4 mm-40 -140.87 60.3 1.52 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.201 -0.937 . . . . 0.0 110.23 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.41 ' OXT' ' CG ' ' A' ' 144' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.183 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.02 75.39 1.51 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.192 -1.181 . . . . 0.0 110.316 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . 0.508 ' O ' ' CG ' ' A' ' 0' ' ' ARG . 0.9 OUTLIER -125.37 146.56 49.53 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.298 -0.876 . . . . 0.0 110.117 179.939 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . 0.508 ' CG ' ' O ' ' A' ' -1' ' ' SER . 0.0 OUTLIER 174.23 83.02 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.282 -0.886 . . . . 0.0 110.155 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -82.53 -8.36 59.61 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.257 -0.902 . . . . 0.0 110.297 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m -130.78 137.83 49.64 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.145 -0.972 . . . . 0.0 110.331 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.43 ' O ' ' CB ' ' A' ' 4' ' ' SER . 28.6 m -90.78 -17.88 25.87 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.232 -0.918 . . . . 0.0 110.257 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' A' ' 3' ' ' THR . 2.1 t 64.76 -175.29 0.17 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.204 -0.935 . . . . 0.0 110.173 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 6' ' ' LEU . 55.2 m -115.89 -70.37 0.8 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.921 . . . . 0.0 110.244 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.406 ' HA ' HD13 ' A' ' 6' ' ' LEU . 0.2 OUTLIER 61.92 129.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.331 -0.855 . . . . 0.0 110.301 -179.995 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -86.04 44.6 1.14 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.26 -0.9 . . . . 0.0 110.23 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 56.9 ttt180 -45.66 -38.8 7.13 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 110.225 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 16.3 tm0? -70.32 113.34 7.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.172 -0.955 . . . . 0.0 110.216 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 66.4 mtt -88.59 -168.96 2.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.245 -0.909 . . . . 0.0 110.239 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -78.28 -154.03 0.07 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.293 -0.879 . . . . 0.0 110.134 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.46 ' O ' ' O ' ' A' ' 13' ' ' ILE . 17.5 t-20 -168.75 50.86 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.193 -0.942 . . . . 0.0 110.244 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.46 ' O ' ' O ' ' A' ' 12' ' ' ASN . 20.4 mt 60.24 142.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.188 -0.945 . . . . 0.0 110.199 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.418 ' CG1' ' CE1' ' A' ' 17' ' ' TYR . 4.6 t -88.81 110.81 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.236 -0.915 . . . . 0.0 110.124 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.464 ' H ' ' CD2' ' A' ' 15' ' ' HIS . 0.6 OUTLIER -98.03 -146.81 0.32 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.203 -0.936 . . . . 0.0 110.295 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -83.57 84.07 7.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.235 -0.916 . . . . 0.0 110.49 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.478 ' CG ' ' O ' ' A' ' 17' ' ' TYR . 19.0 p90 -114.58 130.2 56.75 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.239 -0.913 . . . . 0.0 110.197 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.507 ' O ' ' CB ' ' A' ' 19' ' ' GLU . 15.0 t -145.77 -65.97 0.31 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.31 -0.869 . . . . 0.0 110.075 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.507 ' CB ' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER 166.38 -67.42 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.429 -0.795 . . . . 0.0 110.675 179.975 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.899 ' HB2' HD22 ' A' ' 46' ' ' LEU . . . -71.16 -55.23 8.58 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.193 -0.942 . . . . 0.0 110.625 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HG3' HG12 ' A' ' 22' ' ' ILE . 19.7 pt-20 -41.01 -27.45 0.06 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.291 -0.881 . . . . 0.0 110.461 -179.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.465 HG12 ' HG3' ' A' ' 21' ' ' GLU . 23.5 mm -82.74 -57.81 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.271 -0.893 . . . . 0.0 110.308 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.866 ' O ' HD11 ' A' ' 43' ' ' ILE . 26.2 mttt -53.9 -19.05 3.96 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.241 -0.912 . . . . 0.0 110.409 -179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.934 HG21 ' HA ' ' A' ' 56' ' ' ILE . 6.7 t -89.32 -37.39 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.204 -0.935 . . . . 0.0 110.12 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.501 ' NH2' ' NH1' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -64.66 -36.95 85.93 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.295 -0.878 . . . . 0.0 110.228 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -85.19 -40.56 16.55 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.273 -0.892 . . . . 0.0 110.259 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.613 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . . . -49.48 -38.51 30.28 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.297 -0.877 . . . . 0.0 110.174 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.578 HG22 ' HA ' ' A' ' 77' ' ' ALA . 63.6 p -94.16 50.03 1.36 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.307 -0.87 . . . . 0.0 110.25 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.448 ' HB2' ' O ' ' A' ' 28' ' ' THR . 46.6 t -178.17 -178.67 0.67 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.254 -0.904 . . . . 0.0 110.194 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.421 ' O ' ' OD1' ' A' ' 31' ' ' ASP . 17.5 m-80 -74.85 178.85 5.23 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.201 -0.937 . . . . 0.0 110.185 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 0.6 OUTLIER -143.61 169.22 10.85 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.267 -0.896 . . . . 0.0 110.253 -179.974 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.4 ' O ' ' C ' ' A' ' 33' ' ' TRP . 21.2 Cg_exo -61.16 -166.79 0.04 OUTLIER 'Trans proline' 0 C--N 1.307 -1.623 0 O-C-N 123.924 1.486 . . . . 0.0 110.376 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.4 ' C ' ' O ' ' A' ' 32' ' ' PRO . 0.7 OUTLIER -43.87 -38.16 3.2 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.188 -0.945 . . . . 0.0 110.398 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 136.83 77.42 0.08 OUTLIER Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -64.07 -57.4 0.34 Allowed 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 124.021 1.537 . . . . 0.0 110.268 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 p -151.44 -167.71 2.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.21 -0.931 . . . . 0.0 110.132 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.507 ' O ' ' N ' ' A' ' 39' ' ' LEU . 13.4 m -120.41 -34.73 3.57 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.198 -0.939 . . . . 0.0 110.303 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.8 p -48.59 90.77 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.254 -0.904 . . . . 0.0 110.244 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.613 ' CD1' ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -143.15 -38.0 0.35 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.28 -0.887 . . . . 0.0 110.319 -179.92 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.574 ' HG3' ' CG ' ' A' ' 83' ' ' TYR . 36.2 tpp -82.17 -60.14 2.32 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.514 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 7.8 t -56.89 -21.51 30.16 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.303 -0.873 . . . . 0.0 110.267 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -76.51 -55.78 5.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.25 -0.906 . . . . 0.0 110.221 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.95 HG21 HD11 ' A' ' 80' ' ' LEU . 36.2 mt -49.03 -36.64 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.18 -0.95 . . . . 0.0 110.157 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.521 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -67.63 -55.0 15.04 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.204 -0.935 . . . . 0.0 109.489 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.42 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 22.8 m-20 -50.08 -23.45 2.11 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.097 -1.002 . . . . 0.0 109.14 179.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.923 ' HB3' HD11 ' A' ' 56' ' ' ILE . 7.4 mt -79.1 -40.35 31.36 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.581 -0.699 . . . . 0.0 109.91 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.707 HG21 ' HB3' ' A' ' 84' ' ' LEU . 80.7 p -47.54 -39.71 17.07 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.177 -0.952 . . . . 0.0 109.174 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.575 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 57.9 m-85 -46.06 -50.3 15.36 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 119.384 -0.926 . . . . 0.0 109.289 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.529 ' O ' ' C ' ' A' ' 50' ' ' VAL . 16.5 m-20 -68.14 91.21 0.35 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.57 0.7 . . . . 0.0 110.765 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.529 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -11.0 -57.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.712 178.138 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.527 ' N ' ' O ' ' A' ' 49' ' ' ASN . 2.9 t -64.92 -66.25 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 120.928 -1.108 . . . . 0.0 110.301 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.612 ' O ' HD12 ' A' ' 56' ' ' ILE . . . -37.57 -40.45 0.39 Allowed 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 121.146 0.498 . . . . 0.0 110.762 -177.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.599 ' CE1' ' HG3' ' A' ' 57' ' ' MET . 15.1 t80 -59.07 -54.01 51.9 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.334 -0.854 . . . . 0.0 109.998 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.5 t -55.97 -33.22 64.58 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.19 -0.944 . . . . 0.0 109.862 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -75.42 -27.1 58.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.327 -0.858 . . . . 0.0 109.898 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.934 ' HA ' HG21 ' A' ' 24' ' ' VAL . 8.7 mt -79.68 -70.13 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.394 -0.816 . . . . 0.0 110.026 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.599 ' HG3' ' CE1' ' A' ' 53' ' ' PHE . 75.3 mmm -46.59 -36.35 6.8 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.274 -0.891 . . . . 0.0 109.563 179.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.4 m -55.16 -62.49 1.63 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.366 -0.834 . . . . 0.0 109.939 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.428 ' H ' ' HE3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -59.35 -21.4 59.76 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.188 -0.945 . . . . 0.0 109.798 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.549 ' CG1' HD23 ' A' ' 80' ' ' LEU . 1.0 OUTLIER -76.08 -30.29 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.41 -0.806 . . . . 0.0 109.748 179.871 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.44 ' CD1' ' O ' ' A' ' 57' ' ' MET . 14.0 m95 -76.13 -46.73 27.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.307 -0.87 . . . . 0.0 110.346 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.3 mptt -55.84 -47.67 76.83 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.25 -0.906 . . . . 0.0 110.392 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.501 ' NH1' ' NH2' ' A' ' 25' ' ' ARG . 6.0 mmp_? -75.88 -10.9 59.81 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.326 -0.859 . . . . 0.0 110.338 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.817 ' O ' HD21 ' A' ' 106' ' ' LEU . 6.6 mt -83.55 -17.68 40.96 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.194 -0.941 . . . . 0.0 110.351 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.472 ' O ' ' O ' ' A' ' 66' ' ' ASP . 14.5 m-20 -111.11 42.29 1.67 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.329 -0.857 . . . . 0.0 110.073 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.473 ' OD2' ' HB2' ' A' ' 73' ' ' HIS . 0.9 OUTLIER -53.85 -167.04 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.32 -0.862 . . . . 0.0 110.291 -179.921 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.413 ' O ' ' C ' ' A' ' 68' ' ' GLY . 12.9 p80 -162.72 -169.67 2.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.23 -0.919 . . . . 0.0 110.255 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.535 ' HA2' ' CE2' ' A' ' 111' ' ' TYR . . . 43.82 -121.04 3.43 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.2 ttpt -120.68 66.33 0.85 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.355 -1.086 . . . . 0.0 110.091 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -138.36 25.42 2.67 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.32 -0.862 . . . . 0.0 110.361 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.541 ' CE3' ' HA ' ' A' ' 72' ' ' ARG . 28.7 p-90 -55.03 -18.99 5.99 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 0.0 110.332 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.541 ' HA ' ' CE3' ' A' ' 71' ' ' TRP . 15.2 mtm-85 -48.85 -40.8 30.91 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.208 -0.933 . . . . 0.0 110.235 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.473 ' HB2' ' OD2' ' A' ' 66' ' ' ASP . 17.0 m170 -68.04 -47.81 67.37 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.234 -0.917 . . . . 0.0 110.094 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.631 HG11 ' CG1' ' A' ' 123' ' ' VAL . 7.0 t -46.37 -52.42 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.349 -0.844 . . . . 0.0 110.172 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.53 ' CZ ' ' ND2' ' A' ' 122' ' ' ASN . 19.8 t80 -54.87 -49.05 72.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.342 -0.849 . . . . 0.0 110.33 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.539 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 10.9 mttm -61.92 -22.81 65.9 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.24 -0.913 . . . . 0.0 110.091 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.754 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -80.05 -23.92 41.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.239 -0.913 . . . . 0.0 109.936 179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.556 ' HE2' HG12 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -73.81 -38.45 64.57 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.332 -0.855 . . . . 0.0 110.004 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 76' ' ' LYS . 8.9 t -72.1 -34.32 68.54 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.207 -0.933 . . . . 0.0 110.046 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.95 HD11 HG21 ' A' ' 43' ' ' ILE . 10.1 tp -68.41 -62.0 1.59 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.232 -0.917 . . . . 0.0 108.994 178.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.819 ' HE1' HG22 ' A' ' 103' ' ' VAL . 2.9 ttm -53.69 -32.32 51.29 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.406 -0.808 . . . . 0.0 109.9 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.7 ' HA ' HD12 ' A' ' 85' ' ' ILE . 2.8 tt0 -72.74 -32.82 65.96 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.247 -0.908 . . . . 0.0 109.634 179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.574 ' CG ' ' HG3' ' A' ' 40' ' ' MET . 20.9 t80 -70.75 -38.88 73.53 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.543 -0.723 . . . . 0.0 110.487 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.788 ' HB2' HG11 ' A' ' 92' ' ' VAL . 1.7 mt -70.55 -32.98 70.62 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.107 -0.995 . . . . 0.0 109.578 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.927 HD13 HD21 ' A' ' 134' ' ' LEU . 71.5 mt -61.76 -26.34 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.181 -0.949 . . . . 0.0 110.082 179.654 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.02 -70.64 0.62 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.385 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.521 HG23 ' HB1' ' A' ' 44' ' ' ALA . 13.0 t -94.1 -23.05 18.12 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.236 -0.915 . . . . 0.0 110.4 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.575 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -44.36 -84.54 0.01 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' A' ' 88' ' ' GLY . 14.4 p -178.09 156.37 1.02 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.234 -1.156 . . . . 0.0 110.31 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.78 -21.56 11.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.282 -0.886 . . . . 0.0 110.2 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -70.74 -44.84 65.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.928 . . . . 0.0 109.86 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.788 HG11 ' HB2' ' A' ' 84' ' ' LEU . 55.2 t -53.27 -38.45 31.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.361 -0.837 . . . . 0.0 109.958 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 96' ' ' CYS . 70.5 m -70.79 -41.06 72.15 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.316 -0.865 . . . . 0.0 109.98 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.417 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 31.3 mm-40 -57.07 -54.88 41.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.304 -0.872 . . . . 0.0 109.992 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.9 tp60 -55.86 -36.8 67.97 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.424 -0.797 . . . . 0.0 109.877 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 93' ' ' SER . 4.8 m -60.15 -36.37 77.38 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.315 -0.865 . . . . 0.0 109.736 179.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -74.92 -31.8 61.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.683 179.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 82.2 mt-10 -81.23 -14.78 57.13 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.473 -0.767 . . . . 0.0 110.027 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -123.18 32.87 5.54 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.281 -0.887 . . . . 0.0 110.174 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.6 ttm -58.2 -24.7 60.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.325 -0.86 . . . . 0.0 110.133 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.462 ' O ' ' HB ' ' A' ' 105' ' ' THR . 14.5 m-85 -69.07 -31.83 70.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.919 . . . . 0.0 110.104 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.933 ' O ' HG22 ' A' ' 105' ' ' THR . . . -75.08 -40.03 60.36 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.48 -0.763 . . . . 0.0 110.26 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.819 HG22 ' HE1' ' A' ' 81' ' ' MET . 3.6 t -71.63 -32.37 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.418 -0.801 . . . . 0.0 110.14 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -86.0 -23.36 26.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.281 -0.887 . . . . 0.0 110.508 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.933 HG22 ' O ' ' A' ' 102' ' ' ALA . 7.3 t -51.37 -25.69 6.49 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.082 -1.011 . . . . 0.0 110.002 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.817 HD21 ' O ' ' A' ' 64' ' ' LEU . 50.5 mt -62.39 -43.55 98.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.309 -0.869 . . . . 0.0 110.077 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.51 ' HA ' ' HG2' ' A' ' 124' ' ' ARG . 49.0 mttt -43.73 -36.52 2.28 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.191 -0.943 . . . . 0.0 109.965 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.429 ' O ' ' N ' ' A' ' 110' ' ' GLN . 25.0 t0 -87.03 -31.81 20.34 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.401 -0.812 . . . . 0.0 110.196 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -47.59 97.65 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -0.87 . . . . 0.0 110.02 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.429 ' N ' ' O ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -138.66 151.7 47.42 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.318 -0.864 . . . . 0.0 110.188 -179.913 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.535 ' CE2' ' HA2' ' A' ' 68' ' ' GLY . 0.1 OUTLIER -153.91 105.39 2.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.357 -0.839 . . . . 0.0 110.049 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.739 ' O ' HG12 ' A' ' 112' ' ' VAL . 78.4 t -139.81 57.99 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.27 -0.894 . . . . 0.0 110.238 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -92.62 -42.37 9.69 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.172 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.585 ' CG ' ' N ' ' A' ' 115' ' ' ASP . 0.8 OUTLIER -99.9 -47.17 5.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.203 -0.935 . . . . 0.0 109.916 179.928 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.585 ' N ' ' CG ' ' A' ' 114' ' ' ARG . 6.5 m-20 -60.71 -28.31 68.55 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.525 -0.735 . . . . 0.0 110.124 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 54.01 28.07 39.65 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.532 ' N ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -160.93 102.8 1.3 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -1.16 . . . . 0.0 110.206 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.626 ' CG ' HG21 ' A' ' 112' ' ' VAL . 4.2 m-20 -51.75 115.82 1.83 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.211 -0.93 . . . . 0.0 110.247 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -121.82 -12.94 8.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.27 -0.894 . . . . 0.0 110.251 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -93.83 46.66 2.28 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.1 p -78.98 -41.35 23.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.272 -1.134 . . . . 0.0 110.056 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 3.7 t30 -36.12 -30.33 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 CA-C-O 121.143 0.497 . . . . 0.0 110.582 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.631 ' CG1' HG11 ' A' ' 74' ' ' VAL . 4.6 t -78.16 -58.45 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.3 -0.875 . . . . 0.0 109.826 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.51 ' HG2' ' HA ' ' A' ' 107' ' ' LYS . 10.4 mtp-105 -42.1 -47.29 4.52 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.243 -0.91 . . . . 0.0 111.038 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -72.28 -48.56 41.49 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.381 -0.825 . . . . 0.0 111.662 -178.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.541 ' HA ' ' CE ' ' A' ' 126' ' ' LYS . 0.0 OUTLIER -52.04 -53.6 40.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.837 -1.164 . . . . 0.0 110.15 -179.278 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.462 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -52.2 -43.25 64.1 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.341 -0.849 . . . . 0.0 110.146 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 2.3 tmmm? -55.21 -36.59 66.12 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.207 -0.933 . . . . 0.0 110.371 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -57.45 3.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.161 -0.962 . . . . 0.0 110.294 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 1.039 ' O ' HD23 ' A' ' 134' ' ' LEU . 12.2 tp -46.88 -25.5 0.78 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.208 -0.933 . . . . 0.0 110.041 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 30.0 t -86.64 -36.47 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.219 -0.925 . . . . 0.0 110.155 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.73 -60.46 3.07 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.218 -0.927 . . . . 0.0 110.22 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.98 -28.41 9.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.056 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 1.039 HD23 ' O ' ' A' ' 130' ' ' LEU . 0.8 OUTLIER -67.12 -57.82 6.07 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.28 -0.888 . . . . 0.0 110.261 179.924 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -86.35 96.03 9.85 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.288 -0.882 . . . . 0.0 110.336 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -117.34 -68.15 0.94 Allowed 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.243 -0.91 . . . . 0.0 110.214 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 49.21 92.15 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.262 -0.899 . . . . 0.0 110.252 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -169.06 139.85 2.35 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.249 -0.907 . . . . 0.0 110.203 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.28 131.77 42.33 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.233 -0.917 . . . . 0.0 110.174 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.63 -56.09 1.5 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.313 -0.867 . . . . 0.0 110.235 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.77 83.66 2.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.289 -0.882 . . . . 0.0 110.32 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.409 ' C ' ' OE1' ' A' ' 143' ' ' GLU . 0.5 OUTLIER -109.11 141.29 41.51 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.311 -0.868 . . . . 0.0 110.25 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.418 ' CD ' ' N ' ' A' ' 143' ' ' GLU . 5.5 pm0 -140.87 38.78 1.81 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.22 -0.925 . . . . 0.0 110.149 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.142 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . 0.429 ' O ' ' CB ' ' A' ' -1' ' ' SER . 1.2 m 57.44 50.15 11.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -1.132 . . . . 0.0 110.221 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' -2' ' ' SER . 0.3 OUTLIER 64.98 78.54 0.28 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.281 -0.887 . . . . 0.0 110.234 179.952 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.54 121.89 22.78 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 110.21 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -156.15 -52.63 0.08 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.2 -0.938 . . . . 0.0 110.276 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.1 m -125.05 116.95 22.92 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.28 -0.888 . . . . 0.0 110.228 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 27.0 m -122.48 -7.95 8.61 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.344 -0.847 . . . . 0.0 110.215 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.2 p -86.26 -150.44 0.15 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.296 -0.877 . . . . 0.0 110.236 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 6' ' ' LEU . 53.4 p -157.22 148.88 22.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.298 -0.876 . . . . 0.0 110.16 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.448 ' O ' ' HD3' ' A' ' 8' ' ' ARG . 34.3 tp -179.21 -39.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.166 -0.959 . . . . 0.0 110.331 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.19 102.22 0.08 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.221 -0.924 . . . . 0.0 110.21 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.448 ' HD3' ' O ' ' A' ' 6' ' ' LEU . 5.8 mpt_? -68.42 168.09 13.37 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.202 -0.936 . . . . 0.0 110.197 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -51.12 119.73 4.28 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.251 -0.905 . . . . 0.0 110.351 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 23.2 mmt -100.75 -49.26 4.22 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.305 -0.872 . . . . 0.0 110.274 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -53.47 174.26 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.16 -0.962 . . . . 0.0 110.315 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.462 ' O ' ' HB ' ' A' ' 13' ' ' ILE . 52.9 p-10 -129.84 72.01 1.47 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.208 -0.932 . . . . 0.0 110.283 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.462 ' HB ' ' O ' ' A' ' 12' ' ' ASN . 26.1 mt 60.2 140.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.273 -0.892 . . . . 0.0 110.349 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 4.0 t -100.15 121.41 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.214 -0.929 . . . . 0.0 110.103 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 7.6 m170 -81.86 -16.58 50.27 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.258 -0.901 . . . . 0.0 110.18 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 44.78 45.48 8.31 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.322 -0.861 . . . . 0.0 110.226 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.537 ' CG ' ' O ' ' A' ' 17' ' ' TYR . 26.8 p90 -93.66 124.49 37.69 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.14 -0.975 . . . . 0.0 110.163 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 17' ' ' TYR . 17.9 t -177.08 45.66 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.28 -0.888 . . . . 0.0 110.171 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -136.65 -65.11 0.57 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.202 -0.936 . . . . 0.0 110.268 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.893 ' CB ' HD13 ' A' ' 46' ' ' LEU . . . -58.53 -46.42 86.85 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.378 -0.826 . . . . 0.0 110.286 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.474 ' OE2' ' CG1' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -43.71 -28.28 0.4 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.14 -0.975 . . . . 0.0 110.081 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.474 ' CG1' ' OE2' ' A' ' 21' ' ' GLU . 9.9 mt -86.76 -54.08 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.291 -0.881 . . . . 0.0 110.133 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.544 ' O ' HD11 ' A' ' 43' ' ' ILE . 0.0 OUTLIER -44.6 -37.87 3.88 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 110.153 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.771 HG21 ' HA ' ' A' ' 56' ' ' ILE . 51.2 t -75.06 -48.57 31.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.232 -0.917 . . . . 0.0 110.145 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -46.66 -41.19 14.42 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.136 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.407 ' O ' ' C ' ' A' ' 27' ' ' ALA . 0.0 OUTLIER -74.05 -47.46 36.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.333 -0.855 . . . . 0.0 110.107 179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.697 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -44.44 -47.17 9.88 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.235 -0.916 . . . . 0.0 110.078 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.511 ' HA ' ' HB2' ' A' ' 76' ' ' LYS . 39.5 p -74.3 -31.19 62.39 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.32 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 51.5 m -68.68 162.29 26.39 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.256 -0.902 . . . . 0.0 110.137 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -48.43 169.08 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.203 -0.936 . . . . 0.0 110.139 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -114.85 104.73 53.97 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.21 -0.931 . . . . 0.0 110.228 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -55.67 -163.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 124.069 1.562 . . . . 0.0 110.341 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.1 m95 -96.28 174.78 6.71 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.21 -0.931 . . . . 0.0 110.454 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 120.73 99.72 1.71 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -57.6 -61.5 0.29 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 124.027 1.54 . . . . 0.0 110.298 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.6 m -66.97 94.68 0.34 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.916 . . . . 0.0 110.065 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 96.1 p -144.33 166.74 24.23 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.199 -0.938 . . . . 0.0 110.238 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -172.29 97.0 0.15 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.295 -0.878 . . . . 0.0 110.13 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.697 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.8 OUTLIER -118.82 -22.31 7.43 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.167 -0.958 . . . . 0.0 110.25 -179.942 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -50.67 22.71 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 110.218 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.434 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 89.0 p -58.47 -29.19 65.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -73.11 -47.65 42.47 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.266 -0.896 . . . . 0.0 110.241 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.906 HG21 HD11 ' A' ' 80' ' ' LEU . 23.1 mt -57.68 -38.65 65.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.233 -0.917 . . . . 0.0 110.226 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.649 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -68.61 -47.18 67.34 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.058 -1.027 . . . . 0.0 109.43 179.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.509 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 3.6 t70 -55.41 -18.48 6.94 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.117 -0.99 . . . . 0.0 109.12 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.893 HD13 ' CB ' ' A' ' 20' ' ' ALA . 24.7 mt -85.22 -33.52 22.22 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.531 -0.73 . . . . 0.0 110.191 179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.592 HG21 ' HB3' ' A' ' 84' ' ' LEU . 38.9 p -56.08 -43.74 78.31 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.0 -1.062 . . . . 0.0 109.233 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.544 ' CE2' ' O ' ' A' ' 87' ' ' THR . 95.0 m-85 -41.26 -37.51 0.97 Allowed 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.59 179.537 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.542 ' O ' ' C ' ' A' ' 50' ' ' VAL . 0.8 OUTLIER -80.66 91.21 5.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.591 -0.693 . . . . 0.0 110.365 179.51 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.542 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.09 -58.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.26 178.095 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.541 ' N ' ' O ' ' A' ' 49' ' ' ASN . 2.9 t -65.11 -66.03 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.032 -1.042 . . . . 0.0 110.143 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.742 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -38.19 -44.5 0.86 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.295 0.569 . . . . 0.0 110.522 -177.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.543 ' CA ' ' HA ' ' A' ' 47' ' ' THR . 0.6 OUTLIER -56.73 -55.85 28.88 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.425 -0.797 . . . . 0.0 109.925 179.715 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -54.67 -31.81 58.29 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.194 -0.941 . . . . 0.0 110.232 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -77.79 -26.94 50.04 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.307 -0.871 . . . . 0.0 110.193 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.771 ' HA ' HG21 ' A' ' 24' ' ' VAL . 6.3 mt -78.36 -70.3 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.326 -0.859 . . . . 0.0 110.216 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.466 ' HB3' ' HE2' ' A' ' 57' ' ' MET . 3.5 mtp -46.64 -35.48 6.0 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.177 -0.952 . . . . 0.0 109.762 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 t -55.85 -60.97 2.7 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.258 -0.901 . . . . 0.0 109.659 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.458 ' HB2' HG11 ' A' ' 24' ' ' VAL . 0.6 OUTLIER -60.45 -20.14 58.86 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.266 -0.897 . . . . 0.0 109.679 179.47 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.627 HD11 ' HG ' ' A' ' 80' ' ' LEU . 1.2 mt -75.67 -31.18 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.413 -0.804 . . . . 0.0 109.645 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 17.3 m95 -74.74 -50.27 18.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -0.906 . . . . 0.0 110.202 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -56.14 18.4 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.249 -0.907 . . . . 0.0 110.327 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -68.61 -14.18 62.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.246 -0.909 . . . . 0.0 110.427 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.8 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 4.1 mt -77.69 -25.25 49.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.22 -0.925 . . . . 0.0 110.569 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.462 ' O ' ' O ' ' A' ' 66' ' ' ASP . 1.4 m120 -113.83 43.15 1.87 Allowed 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.343 -0.848 . . . . 0.0 110.185 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.462 ' O ' ' O ' ' A' ' 65' ' ' ASN . 2.3 p-10 -56.03 -159.96 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.353 -0.842 . . . . 0.0 110.427 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.573 ' CD2' ' HB2' ' A' ' 69' ' ' LYS . 0.8 OUTLIER -108.53 -167.37 1.22 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.135 -0.978 . . . . 0.0 110.387 179.974 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -85.91 60.55 4.62 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.573 ' HB2' ' CD2' ' A' ' 67' ' ' HIS . 0.4 OUTLIER -149.93 -74.62 0.16 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.322 -1.105 . . . . 0.0 110.197 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -99.02 50.06 0.96 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.341 -0.849 . . . . 0.0 110.492 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.493 ' CZ2' ' HG3' ' A' ' 119' ' ' GLN . 0.6 OUTLIER -58.01 -14.09 5.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.116 -0.99 . . . . 0.0 110.25 179.816 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -47.5 -35.82 9.37 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.161 -0.962 . . . . 0.0 109.592 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -61.73 -47.86 83.33 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.343 -0.848 . . . . 0.0 109.742 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.636 HG12 ' HE1' ' A' ' 78' ' ' MET . 58.9 t -50.67 -46.19 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.331 -0.855 . . . . 0.0 109.715 179.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.808 ' HB2' HG23 ' A' ' 123' ' ' VAL . 8.4 t80 -57.18 -52.18 66.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.321 -0.862 . . . . 0.0 109.804 179.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.511 ' HB2' ' HA ' ' A' ' 28' ' ' THR . 25.9 mmmt -62.54 -19.37 63.59 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.298 -0.877 . . . . 0.0 109.768 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.8 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -79.48 -30.97 42.28 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.399 -0.813 . . . . 0.0 109.927 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 1.028 ' HE1' HG22 ' A' ' 123' ' ' VAL . 1.2 mpp? -68.36 -46.47 70.01 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 109.859 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.8 t -67.57 -31.86 72.22 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.249 -0.907 . . . . 0.0 109.808 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.906 HD11 HG21 ' A' ' 43' ' ' ILE . 11.2 tp -66.3 -65.4 0.68 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.347 -0.846 . . . . 0.0 109.033 178.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.928 ' HG2' HD21 ' A' ' 130' ' ' LEU . 9.3 ttt -49.38 -32.75 12.1 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.406 -0.809 . . . . 0.0 110.122 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.717 ' HA ' HD12 ' A' ' 85' ' ' ILE . 1.3 tm-20 -70.36 -38.07 74.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.102 -0.999 . . . . 0.0 110.025 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.834 ' CE1' HG21 ' A' ' 87' ' ' THR . 19.7 t80 -68.21 -34.31 76.01 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.255 -0.903 . . . . 0.0 110.677 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.874 ' HB2' HG11 ' A' ' 92' ' ' VAL . 2.8 mt -80.76 -21.79 40.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.019 -1.051 . . . . 0.0 109.924 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.015 HD13 HD11 ' A' ' 134' ' ' LEU . 19.9 mt -65.93 -24.64 34.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.154 -0.966 . . . . 0.0 109.534 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -103.31 -61.38 1.42 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.361 -0.837 . . . . 0.0 109.901 179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.834 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.0 t -98.34 11.39 38.18 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.299 -0.876 . . . . 0.0 109.974 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.652 ' O ' HG23 ' A' ' 92' ' ' VAL . . . -102.2 29.69 11.96 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER 72.6 153.32 0.13 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.391 -1.064 . . . . 0.0 110.43 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.78 -8.71 22.88 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.367 -0.833 . . . . 0.0 110.378 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.416 ' O ' ' HB2' ' A' ' 94' ' ' GLN . 10.4 mmp_? -70.96 -45.07 64.75 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.284 -0.885 . . . . 0.0 109.842 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.874 HG11 ' HB2' ' A' ' 84' ' ' LEU . 91.0 t -52.45 -47.09 47.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 O-C-N 121.409 -0.807 . . . . 0.0 109.898 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.8 t -64.55 -36.78 85.34 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.215 -0.928 . . . . 0.0 109.92 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.477 ' O ' ' HG3' ' A' ' 98' ' ' GLU . 56.3 mm-40 -58.08 -46.65 85.11 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.248 -0.908 . . . . 0.0 109.844 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.457 ' HB3' ' SD ' ' A' ' 57' ' ' MET . 0.1 OUTLIER -60.25 -39.82 88.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.835 . . . . 0.0 109.59 179.415 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.823 ' SG ' HD22 ' A' ' 134' ' ' LEU . 51.5 t -55.02 -40.82 70.59 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.364 -0.835 . . . . 0.0 109.564 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -29.58 64.75 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.48 -0.763 . . . . 0.0 109.669 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 94' ' ' GLN . 0.5 OUTLIER -81.83 -12.52 58.46 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.479 -0.763 . . . . 0.0 110.006 179.788 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.419 ' OD1' ' O ' ' A' ' 98' ' ' GLU . 70.4 m-20 -137.15 42.18 2.42 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.309 -0.869 . . . . 0.0 110.047 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -59.75 -35.67 75.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.272 -0.893 . . . . 0.0 110.237 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.464 ' O ' ' HB ' ' A' ' 105' ' ' THR . 25.4 m-85 -60.97 -25.88 67.16 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.387 -0.821 . . . . 0.0 110.145 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.939 ' O ' HG22 ' A' ' 105' ' ' THR . . . -74.54 -40.82 61.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.332 -0.855 . . . . 0.0 110.159 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.515 HG13 HD23 ' A' ' 130' ' ' LEU . 3.0 t -74.57 -26.52 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.337 -0.852 . . . . 0.0 110.049 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -88.59 -24.02 22.96 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.303 -0.873 . . . . 0.0 110.405 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.939 HG22 ' O ' ' A' ' 102' ' ' ALA . 14.0 t -61.79 -23.75 66.41 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.129 -0.982 . . . . 0.0 110.147 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.759 HD11 HD22 ' A' ' 64' ' ' LEU . 10.6 mt -70.44 -40.44 73.76 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 110.085 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.493 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 0.1 OUTLIER -47.58 -36.1 10.15 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 110.349 179.969 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -91.37 -23.34 20.1 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.376 -0.827 . . . . 0.0 110.288 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -58.03 119.76 7.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.242 -0.911 . . . . 0.0 110.222 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.432 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 0.0 OUTLIER -160.21 140.86 11.91 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.24 -0.912 . . . . 0.0 110.18 179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -161.66 116.43 1.99 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.236 -0.915 . . . . 0.0 110.39 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.94 HG11 ' O ' ' A' ' 117' ' ' LYS . 94.8 t -135.36 62.32 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.26 -0.9 . . . . 0.0 109.996 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 112' ' ' VAL . 3.0 m-20 60.26 178.91 0.09 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.28 -0.887 . . . . 0.0 110.143 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.19 -47.77 54.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.215 -0.928 . . . . 0.0 110.133 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -159.02 70.45 0.49 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.41 -0.806 . . . . 0.0 110.143 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -101.63 -133.22 8.01 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.94 ' O ' HG11 ' A' ' 112' ' ' VAL . 9.9 mtmm -96.54 -150.35 0.33 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.246 -1.15 . . . . 0.0 110.313 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.541 ' HA ' HG21 ' A' ' 112' ' ' VAL . 16.3 t0 -140.78 72.09 1.38 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.291 -0.88 . . . . 0.0 110.143 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.705 HE21 HG22 ' A' ' 112' ' ' VAL . 0.1 OUTLIER -94.25 23.51 5.05 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.217 -0.927 . . . . 0.0 110.18 -179.994 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -104.54 15.17 49.95 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.556 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 3.6 p -82.55 -44.13 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.228 -1.16 . . . . 0.0 110.03 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.556 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 6.5 t30 -43.29 -45.7 6.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.379 -0.825 . . . . 0.0 110.344 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 1.028 HG22 ' HE1' ' A' ' 78' ' ' MET . 1.2 t -82.2 -37.25 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.196 -0.94 . . . . 0.0 110.059 -179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.493 ' HG3' ' HA ' ' A' ' 107' ' ' LYS . 31.1 ttp180 -53.6 -61.5 2.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.08 -1.012 . . . . 0.0 110.837 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 78.9 mt-10 -65.76 -40.65 92.28 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.351 -0.843 . . . . 0.0 111.259 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.519 ' HG3' ' HB3' ' A' ' 78' ' ' MET . 11.2 tptm -52.68 -51.06 61.89 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.073 -1.017 . . . . 0.0 110.203 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.491 ' N ' ' HG2' ' A' ' 78' ' ' MET . . . -58.73 -45.54 89.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.378 -0.826 . . . . 0.0 109.958 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.0 tttm -49.66 -46.41 49.68 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.264 -0.897 . . . . 0.0 109.917 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.64 -51.01 68.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.318 -0.864 . . . . 0.0 110.091 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.928 HD21 ' HG2' ' A' ' 81' ' ' MET . 20.5 tp -47.61 -30.69 3.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.214 -0.929 . . . . 0.0 110.04 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.467 ' O ' ' HG2' ' A' ' 135' ' ' ARG . 28.2 t -81.52 -34.76 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.332 -0.855 . . . . 0.0 110.287 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.438 ' O ' ' N ' ' A' ' 134' ' ' LEU . . . -71.52 -60.36 2.27 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.324 -0.86 . . . . 0.0 110.539 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 132' ' ' ALA . 0.8 OUTLIER -42.1 -26.77 0.11 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 110.387 -179.767 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 1.015 HD11 HD13 ' A' ' 85' ' ' ILE . 0.3 OUTLIER -89.73 -38.47 13.81 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.279 -0.888 . . . . 0.0 110.211 179.978 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -106.35 47.49 0.88 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.239 -0.913 . . . . 0.0 110.103 179.873 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -79.12 -53.63 6.8 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.285 -0.884 . . . . 0.0 110.312 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -81.22 149.11 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.293 -0.879 . . . . 0.0 110.314 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.4 t70 61.11 42.52 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.272 -0.892 . . . . 0.0 110.394 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -23.29 64.04 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.187 -0.946 . . . . 0.0 110.128 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.48 ' O ' HD23 ' A' ' 140' ' ' LEU . 0.3 OUTLIER -63.5 103.68 0.55 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.209 -0.932 . . . . 0.0 110.179 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.91 61.17 0.61 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.298 -0.876 . . . . 0.0 110.155 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.07 107.87 0.13 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.271 -0.893 . . . . 0.0 110.229 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -129.45 -42.23 1.33 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.209 -0.932 . . . . 0.0 110.229 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.229 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.3 127.17 48.17 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.235 -1.156 . . . . 0.0 110.279 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 1.5 m -143.99 28.3 1.4 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.23 -0.919 . . . . 0.0 110.162 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 3.0 tpt180 -164.92 67.19 0.14 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.21 -0.932 . . . . 0.0 110.181 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.61 -4.11 29.13 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 110.207 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.1 p -155.21 -174.3 4.92 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.263 -0.898 . . . . 0.0 110.157 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.676 ' O ' HG23 ' A' ' 3' ' ' THR . 11.6 t -152.58 63.52 0.8 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.171 -0.955 . . . . 0.0 110.137 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -137.44 -171.88 3.08 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.0 110.238 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -137.74 159.25 42.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.278 -0.889 . . . . 0.0 110.012 179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 6' ' ' LEU . 10.6 mt 49.33 80.79 0.06 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.172 -0.955 . . . . 0.0 110.076 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -123.39 -19.19 5.99 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.379 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 9' ' ' GLN . 0.0 OUTLIER -171.94 -48.2 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.242 -0.911 . . . . 0.0 110.308 -179.929 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.453 ' C ' ' O ' ' A' ' 8' ' ' ARG . 0.7 OUTLIER 38.92 42.64 0.67 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.392 -0.818 . . . . 0.0 110.85 179.604 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.36 170.16 12.27 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.148 -0.97 . . . . 0.0 110.036 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.77 -157.34 0.43 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.153 -0.967 . . . . 0.0 110.24 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -149.61 138.24 20.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.368 -0.833 . . . . 0.0 110.094 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.437 ' O ' ' O ' ' A' ' 14' ' ' VAL . 24.0 mt -72.16 152.77 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.114 -0.991 . . . . 0.0 110.162 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.437 ' O ' ' O ' ' A' ' 13' ' ' ILE . 21.5 t -43.45 166.22 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.231 -0.918 . . . . 0.0 110.304 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.418 ' N ' HG12 ' A' ' 14' ' ' VAL . 20.0 m80 -99.58 -31.8 11.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.283 -0.885 . . . . 0.0 110.063 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -91.87 142.12 27.91 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.2 -0.938 . . . . 0.0 110.158 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -72.78 158.18 36.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.186 -0.946 . . . . 0.0 110.241 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -172.71 37.16 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 110.153 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -107.11 34.14 3.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.266 -0.896 . . . . 0.0 110.22 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.694 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -68.55 -41.04 80.37 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.272 -0.893 . . . . 0.0 110.191 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.475 ' HG3' HG13 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -55.11 -25.86 34.35 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.281 -0.887 . . . . 0.0 110.248 -180.0 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.475 HG13 ' HG3' ' A' ' 21' ' ' GLU . 40.8 mt -80.47 -44.9 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.258 -0.901 . . . . 0.0 110.273 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.533 ' HB3' ' CG1' ' A' ' 43' ' ' ILE . 2.1 mtmm -62.75 -32.18 73.26 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.238 -0.914 . . . . 0.0 110.122 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.852 HG21 ' HA ' ' A' ' 56' ' ' ILE . 33.1 t -71.24 -41.32 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.309 -0.869 . . . . 0.0 110.11 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -56.9 -42.49 79.99 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 110.027 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -72.97 -38.15 66.81 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.376 -0.827 . . . . 0.0 110.056 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.795 ' HB2' HD21 ' A' ' 39' ' ' LEU . . . -63.96 -22.16 66.8 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.304 -0.873 . . . . 0.0 110.094 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.88 HG22 ' HA ' ' A' ' 77' ' ' ALA . 13.2 p -103.47 35.22 2.66 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.259 -0.901 . . . . 0.0 110.17 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.96 107.4 0.05 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.231 -0.918 . . . . 0.0 110.123 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -119.83 -59.8 1.77 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.251 -0.906 . . . . 0.0 110.253 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.417 ' CB ' ' CD ' ' A' ' 32' ' ' PRO . 0.2 OUTLIER 61.31 -179.95 0.04 OUTLIER Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.223 -0.923 . . . . 0.0 110.076 179.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.436 ' O ' ' C ' ' A' ' 33' ' ' TRP . 23.4 Cg_exo -59.4 174.24 1.15 Allowed 'Trans proline' 0 C--N 1.306 -1.683 0 O-C-N 123.987 1.519 . . . . 0.0 110.32 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.436 ' C ' ' O ' ' A' ' 32' ' ' PRO . 0.8 OUTLIER 41.07 -159.14 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.423 -0.798 . . . . 0.0 110.598 179.931 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.79 138.58 4.79 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.561 -1.415 . . . . 0.0 109.561 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -68.64 151.8 74.81 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 123.971 1.511 . . . . 0.0 110.402 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.4 m -115.83 149.26 38.88 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.247 -0.908 . . . . 0.0 110.129 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 p -178.58 160.76 1.25 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.935 . . . . 0.0 110.256 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.4 m -60.21 96.92 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.348 -0.845 . . . . 0.0 110.195 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.795 HD21 ' HB2' ' A' ' 27' ' ' ALA . 0.5 OUTLIER -110.48 -10.55 14.55 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.164 -0.96 . . . . 0.0 110.215 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.529 ' CE ' HG22 ' A' ' 79' ' ' THR . 4.2 mmt -86.88 -47.64 8.84 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 110.201 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.485 ' HA ' ' CE1' ' A' ' 83' ' ' TYR . 7.2 t -57.87 -19.78 31.88 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.266 -0.896 . . . . 0.0 110.143 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.424 ' OE2' ' HD3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -82.0 -58.13 3.1 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.237 -0.915 . . . . 0.0 110.192 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.653 HG21 HD21 ' A' ' 80' ' ' LEU . 96.4 mt -50.41 -35.56 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.163 -0.961 . . . . 0.0 109.937 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.621 ' HB1' ' HA2' ' A' ' 88' ' ' GLY . . . -67.32 -54.27 22.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.317 -0.864 . . . . 0.0 109.509 179.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -52.1 -21.88 3.65 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.159 -0.963 . . . . 0.0 108.988 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.705 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 14.1 mt -81.73 -37.83 26.68 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.574 -0.704 . . . . 0.0 109.927 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.509 ' HA ' ' HB2' ' A' ' 53' ' ' PHE . 80.6 p -49.77 -40.91 42.83 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.071 -1.018 . . . . 0.0 109.243 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.587 ' CE2' ' O ' ' A' ' 88' ' ' GLY . 72.4 m-85 -44.39 -47.09 9.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.233 -0.917 . . . . 0.0 109.317 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.547 ' O ' ' C ' ' A' ' 50' ' ' VAL . 2.8 m120 -70.14 90.71 0.67 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.707 -0.621 . . . . 0.0 110.432 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.547 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -10.58 -58.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.269 178.099 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.546 ' H ' HG23 ' A' ' 50' ' ' VAL . 2.6 t -61.75 -64.4 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.096 -1.002 . . . . 0.0 109.943 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.705 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -37.89 -45.24 0.84 Allowed 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.759 -177.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.568 ' CD1' HG22 ' A' ' 92' ' ' VAL . 20.6 t80 -60.99 -53.95 50.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.292 -0.88 . . . . 0.0 110.166 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -53.52 -30.29 40.82 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.291 -0.88 . . . . 0.0 109.946 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -80.15 -29.38 38.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.428 -0.795 . . . . 0.0 110.01 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.852 ' HA ' HG21 ' A' ' 24' ' ' VAL . 10.3 mt -77.79 -69.63 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.356 -0.84 . . . . 0.0 110.09 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.636 ' HE2' ' HG3' ' A' ' 95' ' ' GLN . 0.2 OUTLIER -45.96 -35.45 4.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.27 -0.894 . . . . 0.0 110.111 179.732 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.5 t -58.36 -66.09 0.54 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.279 -0.888 . . . . 0.0 110.197 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.09 -17.24 16.73 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.301 -0.875 . . . . 0.0 109.986 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.901 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.7 OUTLIER -79.12 -33.15 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.37 -0.831 . . . . 0.0 109.813 179.809 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.602 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 12.2 m95 -75.74 -41.78 52.39 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.251 -0.905 . . . . 0.0 110.111 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.1 -57.7 11.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.306 -0.871 . . . . 0.0 110.13 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -66.88 -11.57 56.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 110.12 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.923 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 3.7 mt -80.32 -22.19 41.75 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.197 -0.94 . . . . 0.0 110.265 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.408 ' O ' ' O ' ' A' ' 66' ' ' ASP . 2.9 t30 -101.2 36.32 2.02 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.243 -0.911 . . . . 0.0 109.966 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.731 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.2 OUTLIER -57.21 -162.96 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.288 -0.883 . . . . 0.0 110.323 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.0 m80 -101.32 173.73 6.31 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.313 -0.867 . . . . 0.0 110.316 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.501 ' HA3' ' HB2' ' A' ' 111' ' ' TYR . . . -62.22 -68.81 1.51 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.1 ttpm? -51.82 -26.77 10.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.233 -1.157 . . . . 0.0 110.172 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -105.74 45.65 0.96 Allowed 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.281 -0.887 . . . . 0.0 110.312 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.468 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 64.9 p-90 -76.09 -19.62 58.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.176 -0.953 . . . . 0.0 110.238 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -43.98 -49.84 8.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.257 -0.902 . . . . 0.0 110.108 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -54.08 -49.1 69.85 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 110.2 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.731 HG23 ' HB2' ' A' ' 66' ' ' ASP . 25.0 t -49.48 -49.95 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.325 -0.86 . . . . 0.0 110.278 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.62 ' CE1' ' CD ' ' A' ' 126' ' ' LYS . 6.7 t80 -47.08 -55.25 8.65 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.284 -0.885 . . . . 0.0 110.586 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.527 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -66.88 -23.86 66.05 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.107 -0.996 . . . . 0.0 110.513 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.923 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -68.89 -68.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.234 -0.916 . . . . 0.0 110.378 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.804 ' HE3' HG23 ' A' ' 123' ' ' VAL . 0.3 OUTLIER -49.63 -31.96 11.93 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.381 -0.824 . . . . 0.0 110.192 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.529 HG22 ' CE ' ' A' ' 40' ' ' MET . 95.7 m -55.27 -56.3 21.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.14 -0.975 . . . . 0.0 109.646 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.901 ' CD2' HD11 ' A' ' 60' ' ' ILE . 29.7 tp -51.6 -66.62 0.35 Allowed 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.329 -0.857 . . . . 0.0 108.818 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.602 ' HE1' ' CZ3' ' A' ' 61' ' ' TRP . 47.3 ttm -41.32 -28.49 0.11 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.444 -0.785 . . . . 0.0 110.418 179.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.481 ' CB ' HD12 ' A' ' 130' ' ' LEU . 0.2 OUTLIER -72.3 -47.08 52.71 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.21 -0.931 . . . . 0.0 110.529 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.591 ' CE1' HG21 ' A' ' 87' ' ' THR . 33.6 t80 -70.54 -30.53 67.29 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.236 -0.915 . . . . 0.0 111.355 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.933 ' HB2' HG11 ' A' ' 92' ' ' VAL . 6.7 mt -75.26 -33.29 61.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.941 -1.1 . . . . 0.0 110.521 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.025 HG21 HD11 ' A' ' 134' ' ' LEU . 53.7 mt -62.15 -29.76 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 120.995 -1.065 . . . . 0.0 110.352 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.7 tttt -85.89 -71.13 0.55 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.245 -0.909 . . . . 0.0 110.541 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.591 HG21 ' CE1' ' A' ' 83' ' ' TYR . 11.0 t -94.34 -20.43 19.76 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.198 -0.938 . . . . 0.0 110.446 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.621 ' HA2' ' HB1' ' A' ' 44' ' ' ALA . . . -49.32 -66.4 2.25 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 3.5 t 171.98 158.21 0.09 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.099 -1.236 . . . . 0.0 110.256 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -63.46 -12.91 35.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.293 -0.879 . . . . 0.0 110.263 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.464 ' HD3' ' O ' ' A' ' 47' ' ' THR . 3.9 ptm85 -84.67 -29.18 25.86 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -0.903 . . . . 0.0 110.237 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.933 HG11 ' HB2' ' A' ' 84' ' ' LEU . 59.9 t -67.65 -31.46 52.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.194 -0.941 . . . . 0.0 109.818 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 83.7 p -80.0 -39.19 30.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.324 -0.86 . . . . 0.0 109.712 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -61.58 -51.23 69.41 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.309 -0.87 . . . . 0.0 109.773 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.636 ' HG3' ' HE2' ' A' ' 57' ' ' MET . 5.3 tp-100 -57.67 -40.1 78.58 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.455 -0.778 . . . . 0.0 109.536 179.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 8.5 t -55.62 -37.87 68.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -0.873 . . . . 0.0 109.54 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.93 -32.61 67.5 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.437 -0.789 . . . . 0.0 109.705 179.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -71.16 -24.09 62.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.443 -0.786 . . . . 0.0 109.801 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.76 36.04 4.71 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.44 -0.788 . . . . 0.0 110.106 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.461 ' O ' HG12 ' A' ' 103' ' ' VAL . 0.3 OUTLIER -59.69 -20.67 57.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.333 -0.854 . . . . 0.0 110.271 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.449 ' O ' ' HB ' ' A' ' 105' ' ' THR . 55.1 m-85 -76.24 -28.46 57.16 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.193 -0.942 . . . . 0.0 110.227 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.861 ' O ' HG22 ' A' ' 105' ' ' THR . . . -76.71 -39.03 53.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.925 . . . . 0.0 110.222 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.579 ' CG1' ' N ' ' A' ' 104' ' ' GLN . 3.2 p -74.71 -42.03 47.75 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 CA-C-O 121.942 0.877 . . . . 0.0 109.08 179.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.717 ' OE1' HG21 ' A' ' 131' ' ' VAL . 14.3 mm100 -70.04 -21.78 63.15 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.556 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.861 HG22 ' O ' ' A' ' 102' ' ' ALA . 4.7 t -57.47 -16.08 8.64 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.986 -1.072 . . . . 0.0 109.994 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.76 HD11 HD22 ' A' ' 64' ' ' LEU . 76.4 mt -74.99 -37.42 61.87 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.263 -0.898 . . . . 0.0 110.382 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.495 ' HA ' ' HG3' ' A' ' 124' ' ' ARG . 2.8 pttp -54.47 -18.3 4.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.223 -0.923 . . . . 0.0 110.136 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.438 ' OD2' ' HE3' ' A' ' 107' ' ' LYS . 57.6 m-20 -117.68 -12.32 10.29 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.225 -0.922 . . . . 0.0 110.222 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.441 ' CZ ' ' O ' ' A' ' 66' ' ' ASP . 0.3 OUTLIER -68.49 97.25 0.75 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.305 -0.872 . . . . 0.0 110.321 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -135.98 156.33 48.9 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.262 -0.899 . . . . 0.0 110.076 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.501 ' HB2' ' HA3' ' A' ' 68' ' ' GLY . 0.3 OUTLIER -165.13 107.54 0.82 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.234 -0.917 . . . . 0.0 110.251 -179.926 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 12.9 t -127.23 43.53 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.283 -0.886 . . . . 0.0 110.185 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 52.95 -176.48 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.275 -0.891 . . . . 0.0 110.214 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.78 -46.42 59.52 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.229 -0.92 . . . . 0.0 110.242 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -154.69 110.63 3.19 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.158 -0.964 . . . . 0.0 110.272 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -148.4 -154.17 6.21 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.2 tttm -96.74 130.23 44.01 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.215 -1.168 . . . . 0.0 110.124 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' A' ' 118' ' ' ASP . 19.2 p-10 -62.56 113.7 3.12 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.273 -0.892 . . . . 0.0 110.401 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -130.57 38.62 3.71 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.256 -0.902 . . . . 0.0 110.136 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -120.22 6.83 11.79 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.646 -1.381 . . . . 0.0 109.646 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.557 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.4 p -74.65 -42.49 48.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.23 -1.159 . . . . 0.0 109.954 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.557 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 37.8 m-80 -47.77 -60.32 2.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.434 -0.791 . . . . 0.0 110.282 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.804 HG23 ' HE3' ' A' ' 78' ' ' MET . 14.9 p -72.46 -13.09 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.245 -0.909 . . . . 0.0 110.494 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.509 ' HB3' ' HA ' ' A' ' 121' ' ' VAL . 6.4 ttt180 -74.25 -69.02 0.47 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.14 -0.975 . . . . 0.0 110.563 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.46 -34.92 71.39 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.327 -0.858 . . . . 0.0 110.644 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.62 ' CD ' ' CE1' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -58.31 -56.56 20.51 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.036 -1.04 . . . . 0.0 109.885 179.978 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.762 ' HB2' ' HE1' ' A' ' 78' ' ' MET . . . -54.5 -44.88 73.1 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 109.93 179.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.42 ' HE3' ' HD2' ' A' ' 107' ' ' LYS . 11.2 mtpt -57.29 -35.13 69.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.272 -0.893 . . . . 0.0 110.244 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.438 ' O ' ' HB3' ' A' ' 132' ' ' ALA . 5.2 tt0 -59.44 -48.29 82.22 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.295 -0.878 . . . . 0.0 110.422 -179.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.589 HD21 ' CD1' ' A' ' 85' ' ' ILE . 3.8 tt -55.19 -51.63 65.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.197 -0.939 . . . . 0.0 110.264 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.717 HG21 ' OE1' ' A' ' 104' ' ' GLN . 96.0 t -63.75 -26.89 41.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.423 -0.798 . . . . 0.0 110.387 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 129' ' ' GLN . . . -64.97 -47.03 79.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.278 -0.889 . . . . 0.0 110.186 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.9 mt -58.01 -48.87 78.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.265 -0.897 . . . . 0.0 110.406 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 1.025 HD11 HG21 ' A' ' 85' ' ' ILE . 9.6 mp -67.68 -15.62 63.74 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.218 -0.926 . . . . 0.0 110.383 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.8 ttt-85 -110.66 51.8 0.75 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.182 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.47 ' O ' ' CB ' ' A' ' 137' ' ' GLU . 0.8 OUTLIER -152.18 -61.94 0.16 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.212 -0.93 . . . . 0.0 110.217 -179.991 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.47 ' CB ' ' O ' ' A' ' 136' ' ' ASP . 0.0 OUTLIER 66.74 147.09 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.242 -0.911 . . . . 0.0 110.25 179.991 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.04 168.58 20.79 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.21 -0.931 . . . . 0.0 110.237 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 1.3 ptt180 -59.6 148.63 32.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.24 -0.912 . . . . 0.0 110.151 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 140' ' ' LEU . 0.1 OUTLIER -98.69 81.75 2.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.228 -0.92 . . . . 0.0 110.341 179.992 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.91 60.58 0.86 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.335 -0.853 . . . . 0.0 110.146 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -158.12 151.99 23.89 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.223 -0.923 . . . . 0.0 110.27 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -144.29 -69.12 0.31 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.197 -0.939 . . . . 0.0 110.246 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 118.045 -0.979 . . . . 0.0 110.21 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.27 61.34 1.68 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.224 -1.162 . . . . 0.0 110.22 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 69.2 m -96.79 29.93 2.84 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.259 -0.901 . . . . 0.0 110.171 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -77.14 -158.78 0.11 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.249 -0.907 . . . . 0.0 110.339 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ttp -89.7 -28.85 19.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.276 -0.89 . . . . 0.0 110.116 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.54 157.09 22.48 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.271 -0.893 . . . . 0.0 110.252 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.78 83.56 2.18 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.234 -0.916 . . . . 0.0 110.2 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.0 p -119.41 68.77 0.82 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.298 -0.876 . . . . 0.0 110.208 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.25 -62.84 1.39 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.293 -0.879 . . . . 0.0 110.287 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.416 ' C ' HD23 ' A' ' 6' ' ' LEU . 3.1 tt -148.54 109.76 4.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.25 -0.907 . . . . 0.0 110.367 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -114.69 135.37 54.24 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.237 -0.915 . . . . 0.0 110.224 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -121.64 -76.97 0.58 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.267 -0.896 . . . . 0.0 110.173 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -75.89 117.55 17.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.312 -0.868 . . . . 0.0 110.239 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.483 ' O ' ' C ' ' A' ' 11' ' ' LYS . 11.7 tpt -72.75 -54.03 10.02 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.36 -0.838 . . . . 0.0 110.174 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.502 ' HG3' ' N ' ' A' ' 12' ' ' ASN . 2.4 pttt 33.34 -143.92 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.773 -0.579 . . . . 0.0 111.197 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.502 ' N ' ' HG3' ' A' ' 11' ' ' LYS . 0.9 OUTLIER 59.96 45.9 11.65 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.224 -0.922 . . . . 0.0 109.982 -179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.5 tt -103.13 -175.32 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.255 -0.903 . . . . 0.0 110.167 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.3 m -119.37 141.56 38.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.218 -0.926 . . . . 0.0 110.423 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -104.72 8.98 35.21 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.235 -0.916 . . . . 0.0 110.128 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.82 63.21 1.71 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.317 -0.864 . . . . 0.0 110.163 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -70.17 176.75 3.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.348 -0.845 . . . . 0.0 110.201 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.2 t 50.09 70.2 0.53 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.347 -0.846 . . . . 0.0 110.252 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.431 ' HB2' HD12 ' A' ' 22' ' ' ILE . 2.7 pt-20 -132.01 15.64 4.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.251 -0.905 . . . . 0.0 110.188 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.85 ' HB2' HD13 ' A' ' 46' ' ' LEU . . . -54.16 -46.12 72.23 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 110.115 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 55' ' ' GLU . 3.1 pt-20 -41.87 -46.73 4.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.387 -0.821 . . . . 0.0 110.418 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.435 HG13 ' HG3' ' A' ' 21' ' ' GLU . 63.3 mt -63.13 -44.21 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.223 -0.923 . . . . 0.0 110.023 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.526 ' CG ' HD21 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -57.22 -32.74 66.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.289 -0.882 . . . . 0.0 110.103 179.775 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.901 HG22 HD21 ' A' ' 80' ' ' LEU . 28.2 t -71.72 -28.06 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.148 -0.97 . . . . 0.0 110.018 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -45.32 64.04 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.204 -0.935 . . . . 0.0 109.985 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.435 ' O ' ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -78.54 -22.53 47.14 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.328 -0.857 . . . . 0.0 110.022 179.85 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.457 ' HB2' HD22 ' A' ' 39' ' ' LEU . . . -77.26 -21.98 52.84 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.294 -0.879 . . . . 0.0 110.218 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.444 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 25.2 p -92.93 39.63 1.04 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.225 -0.922 . . . . 0.0 110.199 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -172.97 -165.46 0.3 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.249 -0.907 . . . . 0.0 110.213 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.411 ' ND2' ' N ' ' A' ' 30' ' ' ASN . 1.5 p30 -165.73 166.69 17.69 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.219 -0.925 . . . . 0.0 110.194 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -125.72 158.71 64.24 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 121.271 -0.893 . . . . 0.0 110.246 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.413 ' O ' ' HB2' ' A' ' 33' ' ' TRP . 20.0 Cg_endo -66.68 -173.95 0.42 Allowed 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.037 1.546 . . . . 0.0 110.391 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.413 ' HB2' ' O ' ' A' ' 32' ' ' PRO . 6.1 m95 60.19 -92.89 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.274 -0.891 . . . . 0.0 110.529 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -129.36 93.58 0.34 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -65.42 122.02 9.6 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.022 1.538 . . . . 0.0 110.337 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.4 130.65 47.11 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.175 -0.953 . . . . 0.0 110.18 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.2 t -124.98 83.87 2.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.258 -0.901 . . . . 0.0 110.203 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.8 t -172.76 54.15 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.33 -0.856 . . . . 0.0 110.239 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.587 HD22 HD11 ' A' ' 43' ' ' ILE . 0.8 OUTLIER -127.53 -4.14 6.0 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.257 -0.902 . . . . 0.0 110.137 179.998 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.555 ' HG2' ' CG ' ' A' ' 83' ' ' TYR . 0.2 OUTLIER -77.97 -56.52 4.42 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.235 -0.915 . . . . 0.0 110.182 179.922 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.7 t -62.73 -29.89 71.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.271 -0.893 . . . . 0.0 110.386 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -75.47 -60.46 2.3 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.168 -0.957 . . . . 0.0 110.467 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.67 HG21 HD11 ' A' ' 80' ' ' LEU . 15.8 mt -50.39 -31.65 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.222 -0.924 . . . . 0.0 110.301 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.569 ' HB1' HG23 ' A' ' 87' ' ' THR . . . -70.66 -51.31 28.69 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.071 -1.018 . . . . 0.0 109.418 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.499 ' HA ' ' CD2' ' A' ' 48' ' ' TYR . 0.5 OUTLIER -53.96 -20.6 6.43 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.102 -0.999 . . . . 0.0 108.892 178.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.85 HD13 ' HB2' ' A' ' 20' ' ' ALA . 20.4 mt -81.13 -37.02 29.54 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.535 -0.728 . . . . 0.0 109.954 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.506 ' O ' ' HB2' ' A' ' 53' ' ' PHE . 80.7 p -53.04 -42.87 66.14 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.099 -1.001 . . . . 0.0 109.099 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.499 ' CD2' ' HA ' ' A' ' 45' ' ' ASP . 93.1 m-85 -44.37 -42.22 6.71 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.267 -0.896 . . . . 0.0 109.511 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.532 ' O ' ' N ' ' A' ' 51' ' ' VAL . 5.3 m-80 -73.19 92.64 1.76 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.483 -0.761 . . . . 0.0 110.187 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.526 ' C ' ' O ' ' A' ' 49' ' ' ASN . 0.3 OUTLIER -10.39 -57.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.657 178.343 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.542 HG12 ' N ' ' A' ' 52' ' ' ALA . 3.0 t -65.82 -66.38 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.963 -1.086 . . . . 0.0 110.482 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.725 ' HB3' ' O ' ' A' ' 46' ' ' LEU . . . -36.01 -45.31 0.42 Allowed 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.161 0.505 . . . . 0.0 111.08 -177.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.636 ' CD1' HG22 ' A' ' 92' ' ' VAL . 6.0 t80 -55.68 -58.85 6.08 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.307 -0.871 . . . . 0.0 110.393 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.486 ' O ' ' HB2' ' A' ' 58' ' ' SER . 18.2 m -51.1 -42.03 60.38 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.165 -0.959 . . . . 0.0 110.44 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 1.5 mm-40 -66.33 -30.96 71.48 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.198 -0.939 . . . . 0.0 110.505 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.744 ' HA ' HG21 ' A' ' 24' ' ' VAL . 7.1 mt -74.23 -70.01 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.334 -0.854 . . . . 0.0 110.359 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.419 ' O ' ' CD1' ' A' ' 61' ' ' TRP . 52.6 mmm -46.7 -38.27 9.62 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.131 -0.981 . . . . 0.0 110.128 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.486 ' HB2' ' O ' ' A' ' 54' ' ' SER . 23.2 t -52.7 -60.68 2.96 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.252 -0.905 . . . . 0.0 110.26 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.55 ' HB3' ' CG1' ' A' ' 24' ' ' VAL . 0.0 OUTLIER -58.23 -31.47 67.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.142 -0.974 . . . . 0.0 109.858 179.793 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.7 HD11 ' HG ' ' A' ' 80' ' ' LEU . 0.2 OUTLIER -66.92 -29.59 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.411 -0.806 . . . . 0.0 109.917 179.883 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.548 ' CZ3' ' HE1' ' A' ' 81' ' ' MET . 19.7 m95 -79.39 -41.67 27.22 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.247 -0.908 . . . . 0.0 110.434 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.53 -66.3 0.46 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.249 -0.907 . . . . 0.0 110.636 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -61.37 -23.9 66.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.916 . . . . 0.0 110.606 -179.602 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.868 ' HG ' ' HB1' ' A' ' 77' ' ' ALA . 3.8 mt -60.78 -27.34 67.92 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.151 -0.968 . . . . 0.0 110.337 -179.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.407 ' O ' ' C ' ' A' ' 66' ' ' ASP . 11.5 t30 -103.48 37.3 2.04 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.286 -0.883 . . . . 0.0 110.014 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.673 ' HB2' HG23 ' A' ' 74' ' ' VAL . 0.4 OUTLIER -41.97 156.59 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.423 -0.798 . . . . 0.0 110.286 -179.888 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.73 -171.55 0.07 Allowed 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.636 -0.665 . . . . 0.0 110.128 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -93.68 58.07 2.22 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.1 ttpp -137.18 -37.31 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.165 -1.197 . . . . 0.0 110.368 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -151.72 107.91 3.42 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.3 -0.875 . . . . 0.0 110.414 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.55 ' HB2' HG21 ' A' ' 123' ' ' VAL . 33.1 p-90 -78.29 -5.53 52.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.294 -0.879 . . . . 0.0 110.272 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -45.92 -46.76 16.24 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.298 -0.876 . . . . 0.0 110.285 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -59.81 -40.01 86.98 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.234 -0.916 . . . . 0.0 110.258 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.837 HG12 ' HE2' ' A' ' 78' ' ' MET . 49.6 t -62.02 -57.32 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.172 -0.955 . . . . 0.0 110.272 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 74' ' ' VAL . 4.6 t80 -42.38 -54.54 3.76 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.299 -0.875 . . . . 0.0 110.315 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.444 ' HB3' ' HA ' ' A' ' 28' ' ' THR . 0.0 OUTLIER -61.11 -36.69 80.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.19 -0.944 . . . . 0.0 110.263 179.932 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.868 ' HB1' ' HG ' ' A' ' 64' ' ' LEU . . . -62.41 -25.87 68.18 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.235 -0.916 . . . . 0.0 110.159 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.837 ' HE2' HG12 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -78.57 -35.32 46.06 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.198 -0.939 . . . . 0.0 110.177 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 25.6 m -60.26 -55.26 35.85 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.312 -0.867 . . . . 0.0 109.997 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.901 HD21 HG22 ' A' ' 24' ' ' VAL . 25.5 tp -59.91 -34.63 73.46 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.456 -0.778 . . . . 0.0 109.964 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.65 ' CE ' HD11 ' A' ' 64' ' ' LEU . 15.9 ttm -66.39 -33.74 76.4 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.137 -0.977 . . . . 0.0 110.122 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.746 ' HB2' HD12 ' A' ' 130' ' ' LEU . 3.7 tp10 -77.74 -63.83 1.29 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.295 -0.878 . . . . 0.0 110.144 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.742 ' CE1' HG21 ' A' ' 87' ' ' THR . 54.0 t80 -41.27 -49.65 3.66 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.418 -0.801 . . . . 0.0 110.641 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.535 ' CB ' HG11 ' A' ' 92' ' ' VAL . 81.6 mt -64.72 -43.78 92.32 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.311 -0.868 . . . . 0.0 110.337 -179.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.931 HD11 ' SG ' ' A' ' 96' ' ' CYS . 13.5 mt -49.69 -25.98 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.086 -1.009 . . . . 0.0 109.768 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.8 mttp -97.18 -81.36 0.43 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 110.053 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.742 HG21 ' CE1' ' A' ' 83' ' ' TYR . 13.0 t -72.64 -24.67 61.08 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.301 -0.874 . . . . 0.0 110.271 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.445 ' O ' ' CE2' ' A' ' 48' ' ' TYR . . . -47.22 -77.23 0.11 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.451 ' HB3' HG23 ' A' ' 92' ' ' VAL . 26.7 t -179.17 155.98 0.75 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.159 -1.2 . . . . 0.0 110.326 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -56.91 -17.79 10.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.288 -0.882 . . . . 0.0 110.177 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -83.25 -37.07 24.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.323 -0.86 . . . . 0.0 110.175 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.636 HG22 ' CD1' ' A' ' 53' ' ' PHE . 59.2 t -59.92 -32.14 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.292 -0.88 . . . . 0.0 110.085 179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.0 t -79.01 -40.75 30.63 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.0 179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.527 ' O ' ' CG ' ' A' ' 97' ' ' LYS . 38.9 mt-30 -65.58 -26.14 67.72 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 109.867 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.41 -35.91 60.91 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.244 -0.91 . . . . 0.0 109.519 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.931 ' SG ' HD11 ' A' ' 85' ' ' ILE . 1.3 m -65.61 -37.9 87.92 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.33 -0.856 . . . . 0.0 109.669 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.527 ' CG ' ' O ' ' A' ' 94' ' ' GLN . 0.2 OUTLIER -72.8 -28.14 62.4 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.339 -0.851 . . . . 0.0 109.596 179.349 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.507 ' N ' ' HG3' ' A' ' 97' ' ' LYS . 7.7 mm-40 -75.32 -29.99 60.17 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.368 -0.832 . . . . 0.0 109.348 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.408 ' OD1' ' HB2' ' A' ' 102' ' ' ALA . 22.1 t-20 -116.66 44.38 2.04 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.502 -0.749 . . . . 0.0 109.583 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.41 ' CE ' ' HD2' ' A' ' 135' ' ' ARG . 0.0 OUTLIER -61.32 -29.27 69.78 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.431 -0.793 . . . . 0.0 110.259 -179.864 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.483 ' O ' ' HB ' ' A' ' 105' ' ' THR . 57.9 m-85 -66.44 -24.92 66.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.205 -0.934 . . . . 0.0 109.779 179.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.898 ' O ' HG22 ' A' ' 105' ' ' THR . . . -77.47 -41.32 39.97 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.462 -0.774 . . . . 0.0 110.112 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.599 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 4.0 t -72.33 -31.01 37.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.356 -0.84 . . . . 0.0 110.156 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.497 ' O ' ' CG ' ' A' ' 107' ' ' LYS . 7.5 mm-40 -86.91 -19.41 28.89 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 110.426 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.898 HG22 ' O ' ' A' ' 102' ' ' ALA . 6.6 t -54.7 -18.9 5.17 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.931 . . . . 0.0 109.927 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.619 HD22 HG11 ' A' ' 74' ' ' VAL . 91.3 mt -79.41 -35.65 40.31 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.389 -0.819 . . . . 0.0 110.118 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.593 ' HA ' ' CG ' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -52.54 -18.98 1.97 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.263 -0.898 . . . . 0.0 110.32 179.937 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.471 ' OD1' ' HD2' ' A' ' 107' ' ' LYS . 49.4 m-20 -103.06 -28.96 11.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.209 -0.932 . . . . 0.0 110.463 -179.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.415 ' C ' ' O ' ' A' ' 108' ' ' ASP . 0.1 OUTLIER -43.72 105.47 0.05 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.142 -0.974 . . . . 0.0 110.269 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -145.54 125.94 14.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.316 -0.865 . . . . 0.0 110.164 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -133.37 110.23 9.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.223 -0.923 . . . . 0.0 110.143 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.493 ' O ' HG12 ' A' ' 112' ' ' VAL . 22.5 t -140.38 46.63 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.225 -0.922 . . . . 0.0 110.495 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -93.77 -83.63 0.32 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.19 -0.944 . . . . 0.0 110.102 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.464 ' HD2' ' OD1' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -54.98 -47.55 74.44 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.234 -0.916 . . . . 0.0 110.486 179.944 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.464 ' OD1' ' HD2' ' A' ' 114' ' ' ARG . 59.3 m-20 -68.86 -91.02 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.991 . . . . 0.0 110.324 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.449 ' O ' ' O ' ' A' ' 117' ' ' LYS . . . 134.94 157.2 7.96 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.449 ' O ' ' O ' ' A' ' 116' ' ' GLY . 0.2 OUTLIER 60.78 132.08 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.276 -1.132 . . . . 0.0 110.214 -179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -80.51 128.07 33.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.266 -0.896 . . . . 0.0 110.221 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.455 ' CG ' ' N ' ' A' ' 120' ' ' GLY . 18.8 pt20 -127.59 -36.79 2.03 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.215 -0.928 . . . . 0.0 110.27 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.455 ' N ' ' CG ' ' A' ' 119' ' ' GLN . . . -63.66 91.3 0.09 OUTLIER Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.558 ' CG1' ' N ' ' A' ' 122' ' ' ASN . 4.3 p -129.43 -42.93 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 O-C-N 121.254 -1.145 . . . . 0.0 110.148 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.558 ' N ' ' CG1' ' A' ' 121' ' ' VAL . 6.0 t30 -39.19 -31.77 0.08 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.66 -0.65 . . . . 0.0 110.361 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.629 HG13 ' HE1' ' A' ' 78' ' ' MET . 2.3 t -83.49 -52.62 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.304 -0.872 . . . . 0.0 109.93 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.593 ' CG ' ' HA ' ' A' ' 107' ' ' LYS . 4.4 mtp180 -44.79 -43.67 8.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.142 -0.974 . . . . 0.0 111.176 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -79.33 -46.15 18.25 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.195 -0.94 . . . . 0.0 111.769 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.543 ' CD ' ' HB2' ' A' ' 78' ' ' MET . 0.0 OUTLIER -53.66 -54.92 30.88 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.919 -1.113 . . . . 0.0 110.109 -179.511 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.81 ' HB2' ' SD ' ' A' ' 78' ' ' MET . . . -55.46 -44.22 76.21 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.437 -0.789 . . . . 0.0 110.396 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -58.85 -34.66 71.83 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.168 -0.958 . . . . 0.0 110.5 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -69.41 -53.54 18.85 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.227 -0.921 . . . . 0.0 110.78 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.762 HD21 ' CD1' ' A' ' 85' ' ' ILE . 3.3 tt -47.35 -33.66 6.06 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.09 -1.006 . . . . 0.0 110.416 -179.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.486 HG21 ' HG2' ' A' ' 104' ' ' GLN . 44.8 t -77.26 -35.38 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.252 -0.905 . . . . 0.0 110.333 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -57.19 -49.53 75.7 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.244 -0.91 . . . . 0.0 110.694 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.1 mt -60.93 -56.83 16.52 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.157 -0.965 . . . . 0.0 110.467 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.821 HD11 HD13 ' A' ' 85' ' ' ILE . 0.4 OUTLIER -52.53 -21.96 4.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.18 -0.95 . . . . 0.0 110.284 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.41 ' HD2' ' CE ' ' A' ' 100' ' ' MET . 29.1 ttt85 -132.12 82.76 2.04 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.332 -0.855 . . . . 0.0 110.264 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -147.16 -57.62 0.26 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.256 -0.903 . . . . 0.0 110.244 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.91 166.07 24.95 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.234 -0.916 . . . . 0.0 110.309 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -129.98 174.66 9.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.274 -0.891 . . . . 0.0 110.104 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.09 68.12 0.99 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.259 -0.9 . . . . 0.0 110.3 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.7 mt -68.23 171.42 7.13 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.235 -0.916 . . . . 0.0 110.056 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -113.99 80.71 1.42 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.238 -0.914 . . . . 0.0 110.194 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -133.31 -62.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.267 -0.895 . . . . 0.0 110.037 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -125.4 -46.94 1.75 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.923 . . . . 0.0 110.206 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.249 -179.96 . . . . . . . . 1 1 . 1 stop_ save_